SCHEMBL8602533

SCHEMBL8602533

Cc1nc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2n1CC(=O)N(C)C

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 1/20 0.41
▸ PTGES O14684 3/20 0.41
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ CRHBP P24387 1/20 0.39
▸ CRHR2 Q13324 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ RAB9A P51151 1/20 0.38
▸ S1PR2 O95136 1/20 0.38
▸ LMNA P02545 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ LCK P06239 1/20 0.37

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
SCHEMBL8569083 0.88 MMP2 (0.43) MMP2PTGESMEN1KMT2AHTT
SCHEMBL8597093 0.87 MMP2 (0.42) MMP2PTGESMEN1KMT2AHTT
SCHEMBL8597937 0.86 TP53 (0.43) MMP2PTGESMEN1KMT2AHTT
SCHEMBL8601626 0.85 MAPT (0.47) MMP2PTGESMEN1KMT2AHTT
SCHEMBL8597593 0.84 MMP2 (0.42) MMP2MEN1KMT2AHTTSMN1; SMN2
SCHEMBL8597525 0.84 KMT2A (0.41) MMP2PTGESMEN1KMT2AHTT
Hydrochloric Acid SCHEMBL8603024 0.83 POLB (0.41) MMP2PTGESMEN1KMT2AHTT
SCHEMBL8599397 0.83 MEN1 (0.41) MMP2PTGESMEN1KMT2AHTT
SCHEMBL8601890 0.83 TNF (0.46) MMP2MEN1KMT2AHTTSMN1; SMN2
SCHEMBL8597440 0.82 KDM4E (0.40) MMP2PTGESMEN1KMT2AHTT

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
EP-0863881-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-09-16 — — EP disclosed
WO-1997010219-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-20 — — WO disclosed
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