SCHEMBL2636834

SCHEMBL2636834

O=C(O)c1ccccc1Nc1ccc(Cl)cc1/N=C/c1ccc(Cl)nc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FABP4 P15090 5/20 0.42
▸ FABP3 P05413 3/20 0.42
▸ FTO Q9C0B1 4/20 0.41
▸ TRPA1 O75762 1/20 0.41
▸ DHODH Q02127 2/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ PBRM1 Q86U86 1/20 0.39
▸ CTDSP1 Q9GZU7 1/20 0.39
▸ TTR P02766 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ USP2 O75604 1/20 0.39
▸ MT-CO2 P00403 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ PLA2G1B P04054 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ PGR P06401 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ HTR1A P08908 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
SCHEMBL2636836 1.00 FABP4 (0.42) FABP4FABP3FTOTRPA1DHODH
SCHEMBL2635938 0.85 KMT2A (0.48) FABP4FABP3FTONPC1RAB9A
SCHEMBL2635941 0.85 KMT2A (0.48) FABP4FABP3FTONPC1RAB9A
SCHEMBL2635879 0.84 FTO (0.49) FABP4FABP3FTOTRPA1NPC1
SCHEMBL2635880 0.84 FTO (0.49) FABP4FABP3FTOTRPA1NPC1
SCHEMBL2637295 0.82 ALDH1A1 (0.46) FABP4FABP3FTOTRPA1DHODH
SCHEMBL2637296 0.82 ALDH1A1 (0.46) FABP4FABP3FTOTRPA1DHODH
SCHEMBL2636775 0.81 KDM4E (0.49) FABP4FABP3FTODHODHNPC1
SCHEMBL2636004 0.81 KDM4E (0.49) FABP4FABP3FTODHODHNPC1
SCHEMBL2640798 0.78 FABP4 (0.40) FABP4FABP3FTODHODHNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011140599-A1 CHEMICAL COMPOUND ARRAYS USEFUL FOR DETECTING BACTERIAL PEPTIDES MONASH UNIVERSITY (AU) 2011-11-17 — — WO claimed
WO-2011140599-A1 CHEMICAL COMPOUND ARRAYS USEFUL FOR DETECTING BACTERIAL PEPTIDES MONASH UNIVERSITY (AU) 2011-11-17 — — WO disclosed
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