SCHEMBL27605902

SCHEMBL27605902

O=C(Cc1ccc2[nH]c(-c3ccc(Cl)s3)nc2c1)Nc1ccc(-c2ccccc2)c(CS(=O)(=O)O)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 14/20 0.61
▸ RORC P51449 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ KDR P35968 1/20 0.40
▸ MMP2 P08253 2/20 0.40
▸ MMP9 P14780 2/20 0.40
▸ MMP8 P22894 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ MMP13 P45452 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
SCHEMBL27605905 0.88 F10 (0.74) F10RORCKDR
SCHEMBL3862516 0.82 F10 (0.88) F10KDM4ESMN1; SMN2KDRMEN1
SCHEMBL3868033 0.76 F10 (0.71) F10
SCHEMBL3861744 0.74 F10 (0.47) F10KDM4EMEN1ALDH1A1MAPT
SCHEMBL3872612 0.73 F10 (0.59) F10
SCHEMBL3866715 0.71 F10 (0.88) F10
SCHEMBL3866098 0.71 F10 (0.88) F10
SCHEMBL3861343 0.71 F10 (0.74) F10
SCHEMBL3868937 0.71 F10 (0.74) F10
SCHEMBL3871409 0.70 F10 (0.71) F10

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
CN-1674893-A Benzimidazole derivatives MERCK PATENT GMBH (DE) 2005-09-28 — — CN claimed
CN-1674893-A Benzimidazole derivatives MERCK PATENT GMBH (DE) 2005-09-28 — — CN disclosed
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