SCHEMBL9537029

SCHEMBL9537029

CCC(=O)N1CCC(=O)c2cc(N)ccc21

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.43
CYP11B2 P19099 3/20 0.43
ATAD2 Q6PL18 1/20 0.43
POLB P06746 3/20 0.42
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TSHR P16473 1/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
TP53 P04637 4/20 0.38
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL9540984 0.84 CYP11B1 (0.44) CYP11B1CYP11B2POLBTSHRALDH1A1
SCHEMBL9540553 0.84 MAPT (0.47) CYP11B1CYP11B2POLBTSHRL3MBTL1
SCHEMBL11136938 0.83 NOTUM (0.47) CYP11B1CYP11B2POLBTSHRALDH1A1
SCHEMBL9535907 0.83 NOTUM (0.47) CYP11B1CYP11B2POLBTSHRTP53
SCHEMBL9537960 0.81 TP53 (0.51) HSD17B10ALDH1A1HPGDTP53MAPT
SCHEMBL10869086 0.80 LMNA (0.55) CYP11B1CYP11B2POLBTSHRALDH1A1
SCHEMBL9538201 0.79 BAZ2B (0.50) CYP11B1CYP11B2POLBHSD17B10TSHR
SCHEMBL9537402 0.79 TP53 (0.42) CYP11B1CYP11B2POLBTSHRALDH1A1
SCHEMBL9538328 0.79 ALDH1A1 (0.45) POLBCASP1CASP7TSHRALDH1A1
SCHEMBL27559025 0.78 BRD4 (0.55) CYP11B1CYP11B2ATAD2POLBTSHR

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
EP-0180352-B1 BENZENE-FUSED HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-26 EP disclosed
US-4767780-A SUBSTITUTED 1,4-DIHYDRO-(1)-BENZOPYRANO(4,3-C)PYRAZOLES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-30 US disclosed
US-4675324-A Substituted pyrazolo [4,3-c]pyridines and their use as uricosuric, diuretic and anti-hypertensive agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-23 US disclosed
EP-0180352-A2 Benzene-fused heterocyclic compound FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 EP disclosed