SCHEMBL7116372

SCHEMBL7116372

Cc1nc(-c2cccc(CCC(=O)O)c2)no1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.59
FFAR4 Q5NUL3 1/20 0.57
FFAR1 O14842 9/20 0.53
S1PR1 P21453 1/20 0.50
DAO P14920 1/20 0.49
TSHR P16473 2/20 0.49
KMT2A Q03164 1/20 0.49
RAB9A P51151 2/20 0.48
LMNA P02545 1/20 0.48
NPC1 O15118 1/20 0.48
MAPK1 P28482 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LIPG Q9Y5X9 1/20 0.47
MET P08581 1/20 0.47

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
SCHEMBL12747582 0.86 L3MBTL1 (0.62) L3MBTL1FFAR4FFAR1DAOTSHR
SCHEMBL6565112 0.82 L3MBTL1 (0.59) L3MBTL1FFAR4DAOTSHRKMT2A
SCHEMBL27536208 0.81 L3MBTL1 (0.66) L3MBTL1FFAR4DAOTSHRKMT2A
SCHEMBL1300632 0.80 L3MBTL1 (0.70) L3MBTL1FFAR4S1PR1DAOTSHR
SCHEMBL6326326 0.80 ALDH1A1 (0.59) L3MBTL1FFAR1TSHRKMT2ARAB9A
SCHEMBL13678306 0.79 S1PR1 (0.62) S1PR1
SCHEMBL10066488 0.79 L3MBTL1 (0.72) L3MBTL1FFAR4S1PR1DAOTSHR
SCHEMBL12747584 0.78 L3MBTL1 (0.57) L3MBTL1FFAR4DAORAB9ALMNA
SCHEMBL25254573 0.78 KIFC1 (0.60) L3MBTL1FFAR4S1PR1
SCHEMBL30497131 0.78 KIFC1 (0.60) L3MBTL1FFAR4S1PR1

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-20030135055-A1 Aminosulfonylbiphenyl derivatives MERCK PATENT GMBH (DE) 2003-07-17 US disclosed
EP-1257530-A1 AMINOSULFONYLBIPHENYL DERIVATIVES MERCK PATENT GmbH (DE) 2002-11-20 EP disclosed
WO-2001062717-A1 AMINOSULFONYLBIPHENYL DERIVATIVES MERCK PATENT GMBH (DE) 2001-08-30 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-20030135055-A1 Aminosulfonylbiphenyl derivatives APOB, F12, SERPINB1 L3MBTL1 2669/4885FFAR4 2486/4885FFAR1 2330/4885

“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.