SCHEMBL9386264

SCHEMBL9386264

CCC(C)n1cnc(=O)c2cc(C(=O)OC)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.43
FGFR1 P11362 1/20 0.42
ALDH1A1 P00352 5/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 4/20 0.38
CNR2 P34972 1/20 0.38
HTR7 P34969 1/20 0.38
HTR6 P50406 1/20 0.38
HSD17B10 Q99714 3/20 0.38
HCAR3 P49019 2/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 3/20 0.38
HPGD P15428 2/20 0.37
POLB P06746 1/20 0.37
APOBEC3A P31941 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
PTGER4 P35408 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL14966301 0.72 KDM4E (0.43) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL21394881 0.71 LMNA (0.47) KDM4EALDH1A1LMNAKMT2AHSD17B10
SCHEMBL24596235 0.70 ADORA2A (0.35) KDM4EALDH1A1LMNAHSD17B10TSHR
SCHEMBL15971030 0.68 ALDH1A1 (0.43) KDM4EALDH1A1KMT2AHSD17B10TSHR
SCHEMBL22939299 0.68 CA12 (0.43) KDM4EFGFR1ALDH1A1LMNAKMT2A
SCHEMBL15660917 0.68 KDM4E (0.53) KDM4EFGFR1ALDH1A1LMNAKMT2A
SCHEMBL23467051 0.68 KDM4E (0.47) KDM4EFGFR1ALDH1A1LMNAKMT2A
SCHEMBL15687493 0.68 KDM4E (0.44) KDM4EFGFR1ALDH1A1LMNAKMT2A
SCHEMBL11679816 0.66 FGFR1 (0.60) KDM4EFGFR1ALDH1A1LMNAKMT2A
SCHEMBL15970936 0.66 MEN1 (0.44) KDM4EALDH1A1KMT2AHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0621276-A1 Angiotensin II receptor blocking 2,3,6-substituted quinazolinones AMERICAN CYANAMID COMPANY (US) 1994-10-26 EP disclosed