SCHEMBL7899328

SCHEMBL7899328

CNc1nc2cc(C)ccc2o1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.64
NPC1 O15118 7/20 0.64
MAPT P10636 4/20 0.64
KDM4E B2RXH2 6/20 0.54
HPGD P15428 4/20 0.54
ALDH1A1 P00352 4/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
HSD17B10 Q99714 3/20 0.54
TP53 P04637 2/20 0.54
CASP3 P42574 2/20 0.51
SENP7 Q9BQF6 2/20 0.51
SENP6 Q9GZR1 2/20 0.51
POLB P06746 1/20 0.51
SENP8 Q96LD8 1/20 0.51
FBP1 P09467 2/20 0.50
AGTR1 P30556 1/20 0.47
OPRK1 P41145 1/20 0.47
KMT2A Q03164 1/20 0.47
NFKB1 P19838 2/20 0.46
NFKB2 Q00653 2/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3822363 0.81 RAB9A (0.59) RAB9ANPC1MAPTKDM4EHPGD
SCHEMBL7898926 0.80 FBP1 (0.49) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL14099928 0.80 IL6 (0.58) RAB9ANPC1MAPTKDM4EHPGD
SCHEMBL21154027 0.80 LMNA (0.56) MAPTKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL7891273 0.79 NPC1 (0.42) RAB9ANPC1MAPTFBP1
SCHEMBL20725934 0.78 RAB9A (0.56) RAB9ANPC1MAPTKDM4EHPGD
SCHEMBL128635 0.78 FBP1 (0.61) RAB9ANPC1MAPTKDM4EHPGD
SCHEMBL128647 0.78 AGPAT2 (0.56) RAB9ANPC1MAPTKDM4EHPGD
SCHEMBL13436713 0.78 RAB9A (0.66) RAB9ANPC1MAPTKDM4EHPGD
SCHEMBL23033253 0.77 MAPT (0.54) RAB9ANPC1MAPTKDM4EHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170209448-A1 TREATMENT REGIMENS USING MULTIPLE PHARMACEUTICAL AGENTS INTELLIKINE LLC 2017-07-27 US disclosed
US-9669032-B2 Enhanced treatment regimens using mTOR inhibitors INTELLIKINE LLC (US) 2017-06-06 US disclosed
US-20160287597-A1 Treatment Regimens Using Multiple Pharmaceutical Agents INTELLIKINE LLC 2016-10-06 US disclosed
US-20160287596-A1 Benzoxazole Kinase Inhibitors and Methods of Use FAETH THERAPEUTICS, INC. 2016-10-06 US disclosed
US-20160287595-A1 Combination Pharmaceutical Compositions and Uses Thereof CALITHERA BIOSCIENCES, INC. 2016-10-06 US disclosed
US-20160235758-A1 COMBINATION OF MTOR INHIBITORS AND PI3-KINASE INHIBITORS, AND USES THEREOF INTELLIKINE LLC 2016-08-18 US disclosed
US-9345706-B2 Benzoxazole kinase inhibitors and methods of use INTELLIKINE, LLC (US) 2016-05-24 US disclosed
US-20160089371-A1 Combination of Kinase Inhibitors and Uses Thereof INTELLIKINE LLC 2016-03-31 US disclosed
US-9295673-B2 Combination of mTOR inhibitors and P13-kinase inhibitors, and uses thereof INTELLIKINE LLC (US) 2016-03-29 US disclosed
US-9174994-B2 Enhanced treatment regimens using mTor inhibitors INTELLIKINE, LLC (US) 2015-11-03 US disclosed
US-20150087627-A1 COMBINATION OF KINASE INHIBITORS AND USES THEREOF INTELLIKINE LLC (US) 2015-03-26 US disclosed
US-20140377285-A1 TREATMENT REGIMENS USING MULTIPLE PHARMACEUTICAL AGENTS INTELLIKINE LLC 2014-12-25 US disclosed
US-20140357651-A1 COMBINATION PHARMACEUTICAL COMPOSITIONS AND USES THEREOF CALITHERA BIOSCIENCES, INC. 2014-12-04 US disclosed
US-20140287031-A1 ENHANCED TREATMENT REGIMENS USING MTOR INHIBITORS INTELLIKINE, LLC (US) 2014-09-25 US disclosed
US-20140128599-A1 BENZOXAZOLE KINASE INHIBITORS AND METHODS OF USE INTELLIKINE LLC (US) 2014-05-08 US disclosed
US-20130209543-A1 ENHANCED TREATMENT REGIMENS USING MTOR INHIBITORS INTELLIKINE LLC (US) 2013-08-15 US disclosed
US-8476282-B2 Benzoxazole kinase inhibitors and methods of use INTELLIKINE LLC (US) 2013-07-02 US disclosed
US-8450329-B2 2013-05-28 US disclosed
US-20120294930-A1 COMBINATION OF KINASE INHIBITORS AND USES THEREOF INTELLIKINE LLC (US) 2012-11-22 US disclosed
US-20100184760-A1 Benzoxazole kinase inhibitors and methods of use FAETH THERAPEUTICS, INC. 2010-07-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140128599-A1 BENZOXAZOLE KINASE INHIBITORS AND METHODS OF USE BMX, MTOR, PDPK1 RAB9A 2472/4885NPC1 1622/4885MAPT 3161/4885
US-20160287596-A1 Benzoxazole Kinase Inhibitors and Methods of Use BMX, MTOR, PDPK1 RAB9A 2472/4885NPC1 1622/4885MAPT 3161/4885
US-20100184760-A1 Benzoxazole kinase inhibitors and methods of use BMX, MTOR, PDPK1 RAB9A 2472/4885NPC1 1622/4885MAPT 3161/4885
US-20160287595-A1 Combination Pharmaceutical Compositions and Uses Thereof CDC25C, CCNC, CDC25B RAB9A 3861/4885NPC1 1162/4885MAPT 3779/4885
US-20140287031-A1 ENHANCED TREATMENT REGIMENS USING MTOR INHIBITORS RICTOR, MTOR, RPTOR RAB9A 1532/4885NPC1 494/4885MAPT 2207/4885
US-20130209543-A1 ENHANCED TREATMENT REGIMENS USING MTOR INHIBITORS RICTOR, MTOR, RPTOR RAB9A 1532/4885NPC1 494/4885MAPT 2207/4885
US-20160089371-A1 Combination of Kinase Inhibitors and Uses Thereof MTOR, PIK3CA, AKT1 RAB9A 773/4885NPC1 786/4885MAPT 1913/4885
US-20140377285-A1 TREATMENT REGIMENS USING MULTIPLE PHARMACEUTICAL AGENTS MPL, MTX2, SLC10A1 RAB9A 3154/4885NPC1 97/4885MAPT 1463/4885
US-20150087627-A1 COMBINATION OF KINASE INHIBITORS AND USES THEREOF MTOR, PIK3CA, AKT1 RAB9A 822/4885NPC1 774/4885MAPT 1901/4885
US-20160235758-A1 COMBINATION OF MTOR INHIBITORS AND PI3-KINASE INHIBITORS, AND USES THEREOF MTOR, RPTOR, RICTOR RAB9A 675/4885NPC1 775/4885MAPT 1564/4885
US-20170209448-A1 TREATMENT REGIMENS USING MULTIPLE PHARMACEUTICAL AGENTS MPL, MTX2, SLC10A1 RAB9A 3154/4885NPC1 97/4885MAPT 1463/4885
US-20160287597-A1 Treatment Regimens Using Multiple Pharmaceutical Agents MPL, MTX2, SLC10A1 RAB9A 3154/4885NPC1 97/4885MAPT 1463/4885
US-20120294930-A1 COMBINATION OF KINASE INHIBITORS AND USES THEREOF MTOR, AKT2, MTMR1 RAB9A 981/4885NPC1 759/4885MAPT 1588/4885
US-20140357651-A1 COMBINATION PHARMACEUTICAL COMPOSITIONS AND USES THEREOF CDC25C, CCNC, CDC25B RAB9A 3861/4885NPC1 1162/4885MAPT 3779/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.