SCHEMBL27837204

SCHEMBL27837204

COC(F)(F)c1ccc(NC(C)=O)cc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47
▸ MPO P05164 1/20 0.46
▸ CDK1 P06493 1/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PDK2 Q15119 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ KDM4C Q9H3R0 1/20 0.42
▸ MAP2K1 Q02750 1/20 0.41
▸ RORC P51449 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL7000380 0.77 ALDH1A1 (0.59) MYCKDM4ECDK1SMN1; SMN2ALDH1A1
SCHEMBL27837258 0.76 ALDH1A1 (0.50) KDM4EALDH1A1TDP1
SCHEMBL2500845 0.74 MYC (0.61) MYCKDM4EMPOCDK1SMN1; SMN2
SCHEMBL1671246 0.73 MYC (0.56) MYCKDM4ECDK1SMN1; SMN2L3MBTL1
SCHEMBL1655468 0.73 MYC (0.56) MYCKDM4EMPOCDK1SMN1; SMN2
SCHEMBL30777877 0.73 MYC (0.56) MYCKDM4ECDK1SMN1; SMN2L3MBTL1
SCHEMBL10334083 0.73 CFD (0.63) MYCKDM4ECDK1SMN1; SMN2ALDH1A1
Water SCHEMBL27924364 0.72 MYC (0.55) MYCKDM4ECDK1SMN1; SMN2L3MBTL1
SCHEMBL24381725 0.72 MYC (0.55) MYCKDM4ECDK1SMN1; SMN2L3MBTL1
SCHEMBL170522 0.72 KDM4C (0.62) MYCKDM4ESMN1; SMN2ALDH1A1KDM4C

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
CN-102164911-A 1H-benzimidazole-5-carboxamides as anti-inflammatory agents BOEHRINGER INGELHEIM INT 2011-08-24 — — CN disclosed
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