SCHEMBL7676367

SCHEMBL7676367

CCCCc1nc2ccc(C(=O)N3CCN(C)CC3)cc2n1Cc1ccccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 8/20 0.49
AGTR2 P50052 8/20 0.49
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CNR2 P34972 1/20 0.47
ALDH1A2 O94788 1/20 0.47
ALDH2 P05091 1/20 0.47
ALDH3A1 P30838 1/20 0.47
ALDH1A3 P47895 1/20 0.47
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL7671284 0.90 AGTR1 (0.48) AGTR1AGTR2ALDH1A1KDM4ELMNA
SCHEMBL7675930 0.86 AGTR1 (0.49) AGTR1AGTR2ALDH1A1HPGDCNR2
SCHEMBL6170023 0.86 AGTR1 (0.49) AGTR1AGTR2ALDH1A1HPGDCNR2
SCHEMBL7673014 0.86 ALDH1A1 (0.49) AGTR1AGTR2ALDH1A1KDM4EHPGD
SCHEMBL6170161 0.85 AGTR1 (0.66) AGTR1AGTR2ALDH1A1KDM4ELMNA
SCHEMBL7676791 0.85 AGTR1 (0.51) AGTR1AGTR2ALDH1A1HPGDCNR2
SCHEMBL6168497 0.85 PTGES (0.47) AGTR1AGTR2ALDH1A1HPGDALDH1A2
SCHEMBL7670036 0.84 AGTR1 (0.57) AGTR1AGTR2ALDH1A1KDM4ELMNA
SCHEMBL7671124 0.83 AGTR1 (0.54) AGTR1AGTR2ALDH1A1KDM4ELMNA
SCHEMBL7675595 0.82 AGTR1 (0.53) AGTR1AGTR2ALDH1A1KDM4ELMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6352985-B1 CARDIOVASCULAR DISORDERS OR GASTROINTESTINAL DISORDERS, DIABETES (TYPE II DIABETES), DIABETIC COMPLICATIONS METHOD FOR LOWERING THE BLOOD SUGAR LEVEL OF A PATIENT, FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-05 US disclosed
EP-1132087-A1 REMEDIES FOR POLYCYSTIC OVARY SYNDROME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-09-12 EP disclosed
US-6166219-A Benzimidazole derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-12-26 US disclosed
EP-0882718-A1 BENZIMIDAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed