SCHEMBL2616772

SCHEMBL2616772

CC1=Nc2cc(C)ccc2CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.38
RAB9A P51151 5/20 0.38
HPGD P15428 1/20 0.38
CYP19A1 P11511 4/20 0.37
CYP11B2 P19099 2/20 0.37
MAPT P10636 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HTT P42858 2/20 0.35
KDM4E B2RXH2 2/20 0.35
PKM P14618 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PARP1 P09874 1/20 0.34
PARP10 Q53GL7 1/20 0.34
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
CYP2D6 P10635 1/20 0.34
HTR5A P47898 2/20 0.33

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
SCHEMBL2616783 0.88 NPY5R (0.38) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL2616770 0.83 PDE3B (0.41) NPC1RAB9AHPGDCYP19A1CYP11B2
SCHEMBL10354061 0.81 KMT2A (0.38) NPC1RAB9AMAPTSMN1; SMN2HTT
SCHEMBL17751177 0.74 CSNK2A1 (0.37) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL30681225 0.74 NOS3 (0.57) NPC1RAB9AHPGDCYP19A1CYP11B2
SCHEMBL2230501 0.74 NOS3 (0.57) NPC1RAB9AHPGDCYP19A1CYP11B2
SCHEMBL7495994 0.72 PARP10 (0.35) NPC1RAB9AHPGDCYP19A1CYP11B2
SCHEMBL2616781 0.72 PDE3B (0.39) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL24454359 0.71 L3MBTL1 (0.44) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL7934329 0.69 PARP10 (0.33) NPC1RAB9AHPGDCYP19A1CYP11B2

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11806343-B2 Inhibitors of DUX4 induction for regulation of muscle function SONIC MASTER LIMITED (VG) 2023-11-07 US disclosed
US-11806343-B2 Inhibitors of DUX4 induction for regulation of muscle function SONIC MASTER LIMITED (VG) 2023-11-07 US disclosed
US-20210361641-A1 Inhibitors of DUX4 Induction for Regulation of Muscle Function GENEA BIOCELLS US, INC. 2021-11-25 US disclosed
US-11065243-B2 Inhibitors of DUX4 induction for regulation of muscle function SONIC MASTER LIMITED (VG) 2021-07-20 US disclosed
US-20200330452-A1 Inhibitors of Dux4 Induction for Regulation of Muscle Function SONIC MASTER LIMITED (VG) 2020-10-22 US disclosed
US-8586565-B2 Kinase inhibitors useful for the treatment of myleoproliferative diseases and other proliferative diseases DECIPHERA PHARMACEUTICALS, LLC (US) 2013-11-19 US disclosed
US-20120225057-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF MYELOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2012-09-06 US disclosed
US-8163756-B2 For example,1-(3-t-butyl-1- (1,2,3,4-tetrahydro- isoquinolin-6-yl)-1H- pyrazol-5-yl)-3-(3- cyanophenyl)urea; for treatment of mammalian cancers and inflammatory diseases including rheumatoid arthritis, retinopathies DECIPHERA PHARMACEUTICALS, LLC (US) 2012-04-24 US disclosed
US-20110136760-A1 Kinase Inhibitors Useful for the Treatment of Myleoproliferative Diseases and other Proliferative Diseases DECIPHERA PHARMACEUTICALS, LLC 2011-06-09 US disclosed
US-7790756-B2 Kinase inhibitors useful for the treatment of myleoproliferative diseases and other proliferative diseases DECIPHERA PHARMACEUTICALS, LLC (US) 2010-09-07 US disclosed
US-20080113967-A1 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2008-05-15 US disclosed
US-20080090856-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2008-04-17 US disclosed
US-20070078121-A1 Enzyme modulators and treatments DECIPHERA PHARMACEUTICALS, LLC 2007-04-05 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 (9 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-20120225057-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF MYELOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES ABL1, MCL1, ABL2 NPC1 3601/4885RAB9A 1325/4885HPGD 2917/4885
US-20080090856-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFERATIVE DISEASES AND OTHER PROLIFERATIVE DISEASES MYLK3, MYLK, CDK3 NPC1 3414/4885RAB9A 1929/4885HPGD 2057/4885
US-11806343-B2 Inhibitors of DUX4 induction for regulation of muscle function MUSK, MERTK, PRKDC NPC1 4817/4885RAB9A 2989/4885HPGD 3740/4885
US-20200330452-A1 Inhibitors of Dux4 Induction for Regulation of Muscle Function MUSK, MERTK, PRKDC NPC1 4817/4885RAB9A 2989/4885HPGD 3740/4885
US-20110136760-A1 Kinase Inhibitors Useful for the Treatment of Myleoproliferative Diseases and other Proliferative Diseases MYLK3, MYLK, CDK3 NPC1 3414/4885RAB9A 1929/4885HPGD 2057/4885
US-11065243-B2 Inhibitors of DUX4 induction for regulation of muscle function MUSK, MERTK, PRKDC NPC1 4817/4885RAB9A 2989/4885HPGD 3740/4885
US-20210361641-A1 Inhibitors of DUX4 Induction for Regulation of Muscle Function MUSK, MERTK, PRKDC NPC1 4817/4885RAB9A 2989/4885HPGD 3740/4885
US-20070078121-A1 Enzyme modulators and treatments ABL1, ABL2, LCK NPC1 4813/4885RAB9A 2127/4885HPGD 1537/4885
US-20080113967-A1 ENZYME MODULATORS AND TREATMENTS ABL2, BRAF, MAP3K1 NPC1 4878/4885RAB9A 2892/4885HPGD 1451/4885

“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.