SCHEMBL2297791

SCHEMBL2297791

O=C(Nc1ccc(-c2cc(C(=O)O)on2)cc1)Nc1ccccc1F

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
KDM4E B2RXH2 2/20 0.58
RXFP1 Q9HBX9 1/20 0.58
ALDH1A1 P00352 1/20 0.57
CSGALNACT1 Q8TDX6 12/20 0.56
NPC1 O15118 3/20 0.55
HTT P42858 3/20 0.55
MAPT P10636 3/20 0.55
POLB P06746 1/20 0.54
KDR P35968 2/20 0.53
KIT P10721 1/20 0.53
FLT3 P36888 1/20 0.53
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
EPHB4 P54760 1/20 0.51
TEK Q02763 1/20 0.51

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
SCHEMBL3227975 0.89 RAB9A (0.53) RAB9AMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2299999 0.88 MEN1 (0.60) RAB9AMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2300930 0.85 MEN1 (0.56) RAB9AMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2295862 0.85 MEN1 (0.68) MEN1KMT2AALDH1A1CSGALNACT1MAPT
SCHEMBL2294944 0.85 CSGALNACT1 (0.62) RAB9AMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3237048 0.85 CSGALNACT1 (0.67) CSGALNACT1
SCHEMBL2298617 0.84 RAB9A (0.57) RAB9AMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2298940 0.83 CSGALNACT1 (0.82) CSGALNACT1
SCHEMBL2296895 0.83 CSGALNACT1 (0.60) RAB9AMEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL2297151 0.83 CSGALNACT1 (0.82) CSGALNACT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835428-B2 Diacylglycerol acyltransferase inhibitors Piramal Enterprises Limited (IN) 2014-09-16 US disclosed
US-20110196002-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS PIRAMAL LIFE SCIENCES LIMITED. 2011-08-11 US disclosed
WO-2010023609-A1 OXAZOLE, OXADIAZOLE AND THIAZOLE DERIVATIVES AS DIACYLGLYCEROL ACYLTRANFERASE INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-03-04 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-20110196002-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS DGAT1, DGAT2, DLAT RAB9A 3753/4885MEN1 4530/4885KMT2A 1450/4885

“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.