SCHEMBL24960955

SCHEMBL24960955

CCN1CCCCC1C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 3/20 0.52
KDM4E B2RXH2 6/20 0.44
LTA4H P09960 2/20 0.43
ALDH1A1 P00352 5/20 0.42
POLB P06746 1/20 0.41
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.40
RECQL P46063 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KCNK3 O14649 1/20 0.40
LMNA P02545 1/20 0.40
PDCD1 Q15116 2/20 0.39
CD274 Q9NZQ7 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL15114560 1.00 FKBP1A (0.52) FKBP1AKDM4ELTA4HALDH1A1POLB
SCHEMBL24960953 1.00 FKBP1A (0.52) FKBP1AKDM4ELTA4HALDH1A1POLB
SCHEMBL8977442 0.95 LTA4H (0.47) FKBP1AKDM4ELTA4HALDH1A1POLB
SCHEMBL3315632 0.95 LTA4H (0.47) FKBP1AKDM4ELTA4HALDH1A1POLB
SCHEMBL12677313 0.95 LTA4H (0.47) FKBP1AKDM4ELTA4HALDH1A1POLB
SCHEMBL2773153 0.87 FKBP1A (0.42) FKBP1AKDM4ELTA4HALDH1A1POLB
SCHEMBL13265439 0.86 KCNK3 (0.53) FKBP1AKDM4ELTA4HALDH1A1POLB
SCHEMBL27490418 0.85 ALDH1A1 (0.40) FKBP1AKDM4EALDH1A1POLBTSHR
SCHEMBL28838790 0.85 ALDH1A1 (0.40) FKBP1AKDM4EALDH1A1POLBTSHR
SCHEMBL12125004 0.84 ALDH1A1 (0.56) FKBP1AKDM4EALDH1A1POLBTSHR

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
WO-2023006019-A1 POLYSUBSTITUTED BENZENE PD-L1 INHIBITOR, COMPOSITION AND USE THEREOF 杭州和正医药有限公司 2023-02-02 WO disclosed