SCHEMBL8602955

SCHEMBL8602955

Cc1nc2c(NC(=O)c3c(Cl)cccc3Cl)cccc2n1CC(=O)NCCO

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 1/20 0.43
▸ S1PR2 O95136 1/20 0.41
▸ HTT P42858 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ PKM P14618 1/20 0.38
▸ P2RX7 Q99572 1/20 0.38
▸ CRHBP P24387 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ ITGB1 P05556 2/20 0.37
▸ ITGAV P06756 2/20 0.37
▸ ITGA5 P08648 2/20 0.37
▸ ITGA4 P13612 2/20 0.37
▸ ITGB8 P26012 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ CNR2 P34972 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
SCHEMBL8668515 0.85 S1PR2 (0.38) MMP2S1PR2HTTLMNATSHR
SCHEMBL8597757 0.85 L3MBTL1 (0.46) MMP2S1PR2HTTLMNASMN1; SMN2
SCHEMBL8597525 0.85 KMT2A (0.41) MMP2HTTLMNATSHRSMN1; SMN2
SCHEMBL8569083 0.85 MMP2 (0.43) MMP2HTTLMNATSHRSMN1; SMN2
SCHEMBL8597093 0.84 MMP2 (0.42) MMP2HTTLMNATSHRSMN1; SMN2
Hydrochloric Acid SCHEMBL8603024 0.84 POLB (0.41) MMP2HTTLMNATSHRSMN1; SMN2
SCHEMBL8601626 0.83 MAPT (0.47) MMP2HTTLMNATSHRSMN1; SMN2
SCHEMBL8602533 0.82 MMP2 (0.41) MMP2S1PR2HTTLMNATSHR
SCHEMBL8603067 0.82 L3MBTL1 (0.45) MMP2S1PR2HTTLMNASMN1; SMN2
SCHEMBL8597593 0.82 MMP2 (0.42) MMP2HTTLMNATSHRSMN1; SMN2

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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