SCHEMBL30097044

SCHEMBL30097044

CC1(C=O)CCc2ccc(C(=O)O)cc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.52
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
POLB P06746 2/20 0.47
BLM P54132 2/20 0.47
CYP2C19 P33261 2/20 0.47
GRM1 Q13255 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
RARB P10826 11/20 0.44
RXRA P19793 10/20 0.44
RARG P13631 10/20 0.44
RARA P10276 9/20 0.44
RXRB P28702 5/20 0.44
RXRG P48443 3/20 0.44
CYP26A1 O43174 2/20 0.44
CYP26B1 Q9NR63 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
SCHEMBL23706010 1.00 KDM1A (0.52) KDM1AKDM4EALDH1A1MAPTPOLB
SCHEMBL30042034 0.75 KDM1A (0.52) KDM1AKDM4EALDH1A1MAPTPOLB
SCHEMBL23705938 0.75 KDM1A (0.52) KDM1AKDM4EALDH1A1MAPTPOLB
SCHEMBL19764448 0.75 KDM1A (0.73) KDM1AKDM4EALDH1A1MAPTPOLB
SCHEMBL23706158 0.75 KDM1A (0.52) KDM1AKDM4EALDH1A1MAPTPOLB
SCHEMBL30042598 0.75 KDM1A (0.52) KDM1AKDM4EALDH1A1MAPTPOLB
SCHEMBL9551744 0.74 RXRA (0.63) KDM1AKDM4EALDH1A1MAPTPOLB
SCHEMBL23705405 0.74 KDM1A (0.51) KDM1AKDM4EALDH1A1MAPTPOLB
SCHEMBL24401007 0.73 KDM1A (0.58) KDM1AKDM4EALDH1A1MAPTPOLB
SCHEMBL8458491 0.73 ALDH1A1 (0.65) KDM1AKDM4EALDH1A1MAPTPOLB

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-4096667-A1 COMPOUNDS AND USES THEREOF Foghorn Therapeutics Inc. (US) 2022-12-07 EP disclosed