SCHEMBL339377

SCHEMBL339377

CC(=O)c1cc(N(C)C)ccc1NC(=O)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.57
RAB9A P51151 6/20 0.57
SMN1; SMN2 Q16637 5/20 0.57
CASP3 P42574 1/20 0.57
TAAR1 Q96RJ0 1/20 0.57
SENP7 Q9BQF6 1/20 0.57
NOX1 Q9Y5S8 1/20 0.57
FLT3 P36888 1/20 0.56
NR1H4 Q96RI1 1/20 0.55
MAOB P27338 2/20 0.54
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
RXFP1 Q9HBX9 1/20 0.53
MAPK1 P28482 1/20 0.51
HSD17B10 Q99714 1/20 0.51
MAPK14 Q16539 1/20 0.49
SMO Q99835 1/20 0.49
KDM4E B2RXH2 2/20 0.49
MAPT P10636 2/20 0.49
ALDH1A1 P00352 2/20 0.49

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
SCHEMBL340956 0.89 KMT2A (0.62) SMN1; SMN2TAAR1FLT3NR1H4MAOB
SCHEMBL339705 0.83 MEN1 (0.60) NPC1MEN1KMT2AALDH1A1
SCHEMBL2963776 0.80 MAPK14 (0.68) NPC1RAB9ASMN1; SMN2NR1H4MEN1
SCHEMBL15233688 0.79 RAB9A (0.64) NPC1RAB9ASMN1; SMN2CASP3TAAR1
SCHEMBL341381 0.79 MAPT (0.63) NPC1RAB9ASMN1; SMN2CASP3TAAR1
SCHEMBL6577738 0.79 NPC1 (0.63) NPC1RAB9ASMN1; SMN2CASP3TAAR1
SCHEMBL15233671 0.77 KDM4E (0.56) NPC1RAB9ASMN1; SMN2CASP3TAAR1
SCHEMBL341357 0.77 KMT2A (0.69) TAAR1FLT3MEN1KMT2AMAPK1
SCHEMBL4476253 0.76 MAOB (0.66) NPC1RAB9ASMN1; SMN2CASP3SENP7
SCHEMBL2290164 0.76 SMN1; SMN2 (0.76) NPC1RAB9ASMN1; SMN2CASP3TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3112348-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES Tairx, Inc. (TW) 2017-01-04 EP disclosed
EP-2593435-B1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES TAIRX INC (TW) 2016-09-07 EP disclosed
US-8524740-B2 Synthesis and anticancer activity of aryl and heteroaryl-quinolin derivatives TAIRX, INC. (TW) 2013-09-03 US disclosed
EP-2593435-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES Tairx, Inc. (TW) 2013-05-22 EP disclosed
US-20120015908-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES Efficient Pharma Management Corporate (TW) 2012-01-19 US disclosed
WO-2012009519-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES EFFICIENT PHARMA MANAGEMENT CORP. (TW) 2012-01-19 WO 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 (1 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-20120015908-A1 SYNTHESIS AND ANTICANCER ACTIVITY OF ARYL AND HETEROARYL-QUINOLIN DERIVATIVES SLC22A8, ABCC8, CYP2C8 NPC1 874/4885RAB9A 546/4885SMN1; SMN2 3441/4885

“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.