SCHEMBL7990151

SCHEMBL7990151

Cc1ccccc1C(NC(c1ccccc1)c1ccccc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
ACP3 P15309 1/20 0.46
SLC6A9 P48067 1/20 0.46
LMNA P02545 3/20 0.41
HSD17B2 P37059 1/20 0.41
TSHR P16473 1/20 0.41
TAAR1 Q96RJ0 1/20 0.40
NR3C2 P08235 1/20 0.40
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
APAF1 O14727 1/20 0.39
CYP2C19 P33261 2/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL7996778 0.87 ALDH1A1 (0.52) ALDH1A1ACP3SLC6A9LMNAHSD17B2
SCHEMBL4610114 0.80 CYP2D6 (0.48) ALDH1A1LMNATSHRAPAF1CYP3A4
SCHEMBL4610111 0.80 CYP2D6 (0.48) ALDH1A1LMNATSHRAPAF1CYP3A4
SCHEMBL3724579 0.77 ALDH1A1 (0.44) ALDH1A1ACP3NR3C2HPGDPOLB
SCHEMBL8859215 0.77 ITGB3 (0.44) ALDH1A1ACP3SLC6A9L3MBTL1
SCHEMBL5324207 0.76 HPGD (0.43) ALDH1A1ACP3LMNATSHRGAA
SCHEMBL16371412 0.76 ALDH1A1 (0.43) ALDH1A1ACP3HPGDL3MBTL1
SCHEMBL19524599 0.74 SLC6A9 (0.50) ALDH1A1ACP3SLC6A9LMNAHSD17B2
SCHEMBL2707682 0.73 ATM (0.42) ALDH1A1ACP3CYP2C19CYP3A4CYP2C9
SCHEMBL21279698 0.73 SLC1A3 (0.46) ALDH1A1ACP3CYP2C19CYP1A2CYP3A4

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-20110059940-A1 2-Aryl Glycinamide Derivatives BRISTOL- MYERS SQUIBB COMPANY 2011-03-10 US disclosed
US-20110059940-A1 2-Aryl Glycinamide Derivatives BRISTOL- MYERS SQUIBB COMPANY 2011-03-10 US disclosed
WO-2009137657-A1 2-ARYL GLYCINAMIDE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 2009-11-12 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-20110059940-A1 2-Aryl Glycinamide Derivatives IAPP, APP, BACE1 ALDH1A1 3029/4885ACP3 547/4885SLC6A9 2450/4885

“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.