SCHEMBL6487009

SCHEMBL6487009

Cc1ccccc1-c1nc(CCl)co1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.46
RAB9A P51151 11/20 0.46
SMN1; SMN2 Q16637 9/20 0.46
CASP3 P42574 2/20 0.46
SENP8 Q96LD8 2/20 0.46
SENP7 Q9BQF6 2/20 0.46
SENP6 Q9GZR1 2/20 0.46
ENPP3 O14638 1/20 0.44
ENPP1 P22413 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.41
MAPK1 P28482 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
TSHR P16473 4/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
KDM4E B2RXH2 3/20 0.40
HSD17B10 Q99714 2/20 0.40
PRNP P04156 1/20 0.38
PPARG P37231 1/20 0.38
MAPK10 P53779 1/20 0.38

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
SCHEMBL12876360 0.84 ENPP3 (0.35) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL5015991 0.81 ALDH1A1 (0.50) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL2227527 0.80 NOTUM (0.45) NPC1RAB9ASMN1; SMN2L3MBTL1MAPK1
SCHEMBL28524363 0.80 PTPN11 (0.45) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL6965803 0.80 HDAC1 (0.50) NPC1RAB9ASMN1; SMN2L3MBTL1MAPK1
SCHEMBL17068993 0.77 RAB9A (0.53) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL1696172 0.76 ESR2 (0.36) NPC1RAB9AL3MBTL1TDP1ALDH1A1
SCHEMBL28494497 0.76 NOTUM (0.49) MAPK1TDP1TSHRALDH1A1HSD17B10
SCHEMBL1436020 0.75 DRD2 (0.58) ENPP3ENPP1TSHRALDH1A1PPARG
SCHEMBL3070904 0.73 ACACB (0.37) NPC1RAB9ASMN1; SMN2KDM4EPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111978268-A 1- (4-chlorphenyl) -2-cyclopropyl acetone oxime oxazole methyl ether and application thereof 湖南大学 2020-11-24 CN disclosed
WO-2019175464-A1 COMPOUNDS USEFUL AS INHIBITORS OF SODIUM-CALCIUM EXCHANGER (NCX) ORION CORPORATION (FI) 2019-09-19 WO disclosed
US-6933322-B2 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus WYETH (US) 2005-08-23 US disclosed
US-20030216442-A1 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus WYETH 2003-11-20 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 (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-20030216442-A1 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus INSR, GPR119, SLC5A1 NPC1 218/4885RAB9A 1302/4885SMN1; SMN2 1928/4885

“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.