SCHEMBL27624731

SCHEMBL27624731

O=C(NCc1ccc2[nH]c(Cc3ccc(Cl)s3)nc2c1)c1ccc(N2CCCCC2=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 8/20 0.54
▸ MAPT P10636 1/20 0.52
▸ LMNA P02545 2/20 0.48
▸ F2 P00734 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ HPGD P15428 2/20 0.45
▸ CYP1A2 P05177 1/20 0.43
▸ NAMPT P43490 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ METTL3 Q86U44 1/20 0.40
▸ METTL14 Q9HCE5 1/20 0.40

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
SCHEMBL27605901 0.89 F10 (0.46) F10MAPTLMNAF2SMN1; SMN2
SCHEMBL3861689 0.86 F10 (0.69) F10MAPTLMNAF2ALDH1A1
SCHEMBL3864135 0.81 F10 (0.65) F10MAPTLMNAF2ALDH1A1
SCHEMBL3864158 0.75 F10 (0.72) F10MAPTLMNAHPGD
SCHEMBL3864701 0.74 F10 (0.67) F10F2ALDH1A1HPGD
SCHEMBL3867575 0.73 F10 (0.64) F10MAPTLMNAF2HPGD
SCHEMBL5442581 0.72 F10 (0.70) F10MAPTLMNAF2ALDH1A1
SCHEMBL3872206 0.70 F10 (0.61) F10MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL3866715 0.70 F10 (0.88) F10
SCHEMBL1678573 0.70 F10 (0.60) F10MAPTLMNASMN1; SMN2HPGD

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