SCHEMBL29924288

SCHEMBL29924288

N#Cc1ccc(C[O])c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.45
FFAR4 Q5NUL3 5/20 0.45
CTSB P07858 1/20 0.40
NR3C1 P04150 1/20 0.37
PGR P06401 1/20 0.37
NR3C2 P08235 1/20 0.37
CYP19A1 P11511 1/20 0.37
MAP2K1 Q02750 1/20 0.36
TSPO P30536 1/20 0.36
DRD3 P35462 1/20 0.36
KIF11 P52732 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
KCNH2 Q12809 1/20 0.36
VNN1 O95497 1/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36

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
SCHEMBL15018170 1.00 FFAR1 (0.45) FFAR1FFAR4CTSBNR3C1PGR
SCHEMBL14625917 0.84 FFAR1 (0.42) FFAR1FFAR4CTSBNR3C1PGR
SCHEMBL1642300 0.84 FFAR1 (0.48) FFAR1FFAR4CTSBNR3C1PGR
SCHEMBL15018450 0.84 MPO (0.43) FFAR1FFAR4MAP2K1KIF11KCNH2
SCHEMBL7770769 0.82 FFAR1 (0.43) FFAR1FFAR4CTSBNR3C1PGR
SCHEMBL24136215 0.80 FFAR1 (0.45) FFAR1FFAR4CTSBNR3C1PGR
SCHEMBL5047708 0.80 LOXL2 (0.47) FFAR1FFAR4CTSBNR3C1PGR
SCHEMBL1162443 0.80 FFAR1 (0.45) FFAR1FFAR4CTSBNR3C1PGR
SCHEMBL309991 0.80 FFAR1 (0.42) FFAR1FFAR4CTSBNR3C1PGR
SCHEMBL5316641 0.80 FFAR1 (0.42) FFAR1FFAR4CTSBNR3C1PGR

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-2022228490-A1 POLYCYCLIC DERIVATIVE MODULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2022-11-03 WO disclosed