SCHEMBL12291367

SCHEMBL12291367

Cc1cccc(NCc2cc(=O)n3nc(-c4ccccc4)cc3[nH]2)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
PARP1 P09874 7/20 0.42
FABP4 P15090 1/20 0.39
MAPT P10636 4/20 0.38
TP53 P04637 3/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
EGFR P00533 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL12326343 0.90 FABP4 (0.50) PARP1FABP4MAPTTP53
SCHEMBL12289539 0.81 ADORA3 (0.41) LMNAFABP4MAPTTP53GAA
SCHEMBL12291365 0.77 PARP1 (0.53) LMNAPARP1MAPTTP53GAA
SCHEMBL12289530 0.76 MAPT (0.40) LMNAFABP4MAPTTP53GAA
SCHEMBL12289704 0.75 TP53 (0.36) LMNAFABP4MAPTTP53GAA
SCHEMBL12291355 0.75 TGFBR1 (0.38) LMNAMAPTTP53GAAMAPK1
SCHEMBL12289526 0.74 NPSR1 (0.40) LMNAMAPTTP53GAAMAPK1
SCHEMBL12290398 0.74 PARP1 (0.53) PARP1MAPTTP53NPC1RAB9A
SCHEMBL12289435 0.73 KDM4E (0.35) LMNAFABP4MAPTTP53GAA
SCHEMBL12289519 0.73 ADORA3 (0.43) MAPTTP53HSD17B10ALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110237575-A1 INHIBITORS OF FATTY ACID BINDING PROTEIN (FABP) MERCK SHARP & DOHME LLC 2011-09-29 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-20110237575-A1 INHIBITORS OF FATTY ACID BINDING PROTEIN (FABP) FABP4, FABP1, FABP3 LMNA 2616/4885PARP1 3850/4885FABP4 1/4885

“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.