SCHEMBL903576

SCHEMBL903576

Cc1ccc(NC(=O)c2cccc(C(=O)O)c2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.75
KMT2A Q03164 6/20 0.75
NPC1 O15118 4/20 0.72
RAB9A P51151 4/20 0.72
SMN1; SMN2 Q16637 3/20 0.72
MAPT P10636 1/20 0.72
PKM P14618 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
TP53 P04637 4/20 0.66
KDM4E B2RXH2 1/20 0.66
TSHR P16473 1/20 0.66
NFKB1 P19838 1/20 0.66
NFKB2 Q00653 1/20 0.66
RELA Q04206 1/20 0.66
THRB P10828 1/20 0.65
RXFP1 Q9HBX9 1/20 0.63
HPSE Q9Y251 1/20 0.60
GFER P55789 1/20 0.59
NR1H4 Q96RI1 2/20 0.59
FFAR1 O14842 1/20 0.58

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
SCHEMBL2058359 0.88 KMT2A (0.96) MEN1KMT2ANPC1RAB9APKM
SCHEMBL10199571 0.87 NPC1 (0.67) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL4257440 0.86 NPC1 (0.81) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL30048093 0.86 NPC1 (0.81) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL11474161 0.86 KMT2A (0.79) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL9067770 0.86 KMT2A (1.00) MEN1KMT2ANPC1RAB9APKM
SCHEMBL7822889 0.85 MEN1 (0.78) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL7234090 0.85 NPC1 (0.65) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL2076281 0.85 HPSE (0.72) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL82305 0.84 RAB9A (1.00) MEN1KMT2ANPC1RAB9ASMN1; SMN2

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-9321766-B1 Kinase inhibitors ALLERGAN, INC. (US) 2016-04-26 US disclosed
US-20160096832-A1 KINASE INHIBITORS ALLERGAN, INC. 2016-04-07 US disclosed
WO-2012041987-A1 SUBSTITUTED N-(2-ARYLAMINO)ARYL SULFONAMIDE-CONTAINING COMBINATIONS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-04-05 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-20160096832-A1 KINASE INHIBITORS ABL1, LCK, ERBB2 MEN1 2293/4885KMT2A 1569/4885NPC1 4204/4885

“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.