SCHEMBL7359072

SCHEMBL7359072

COC(=O)CCc1nc2ccc(N)cc2n1Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
HDAC1 Q13547 1/20 0.49
POLB P06746 1/20 0.49
BRD4 O60885 1/20 0.48
DRD2 P14416 1/20 0.46
TBXA2R P21731 1/20 0.46
AGTR1 P30556 2/20 0.46
AGTR2 P50052 2/20 0.46
PPARG P37231 4/20 0.46
CYP11B1 P15538 1/20 0.45
CYP11B2 P19099 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL7348274 0.91 KDM4E (0.59) KDM4EHDAC1POLBDRD2TBXA2R
SCHEMBL945578 0.75 POLB (0.61) POLBAGTR1AGTR2PPARGSMN1; SMN2
SCHEMBL6484666 0.75 AGTR1 (0.54) AGTR1AGTR2PPARG
SCHEMBL19156191 0.74 POLB (0.60) POLBDRD2TBXA2RAGTR1AGTR2
SCHEMBL615476 0.73 TNF (0.68) KDM4EBRD4SMN1; SMN2
SCHEMBL17381121 0.73 MEN1 (0.49) KDM4EHDAC1POLBDRD2TBXA2R
SCHEMBL7763084 0.72 POLB (0.64) KDM4EPOLBAGTR1AGTR2PPARG
SCHEMBL8788433 0.72 AGTR1 (0.59) AGTR1AGTR2PPARG
SCHEMBL8395423 0.72 AGTR1 (0.79) AGTR1AGTR2PPARG
SCHEMBL10443035 0.72 TLR7 (0.54) AGTR1AGTR2PPARG

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
US-5741804-A Substituted benzimazoles which inhibit platelet aggrecation SMITHKLINE BEECHAM CORPORATION (US) 1998-04-21 US disclosed
WO-1994012478-A1 BENZIMIDAZOLE COMPOUNDS WHICH INHIBIT PLATELET AGGREGATION SMITHKLINE BEECHAM CORPORATION (US) 1994-06-09 WO disclosed