SCHEMBL22728952

SCHEMBL22728952

CCCC1(C)CCNC1=O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 6/20 0.39
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD11B1 P28845 7/20 0.32
HSD17B10 Q99714 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL7448243 0.83
SCHEMBL25134507 0.83
SCHEMBL21426014 0.79 CYP19A1 (0.31) CYP19A1
SCHEMBL22213505 0.77 CYP19A1 (0.38) CYP19A1TSHRNPSR1HSD17B10KDM4E
SCHEMBL17980313 0.77
SCHEMBL6124723 0.77
SCHEMBL19534246 0.77 CYP19A1 (0.40) CYP19A1HSD11B1
Hydrochloric Acid SCHEMBL26618937 0.75 CYP19A1 (0.33) CYP19A1TSHRNPSR1
SCHEMBL28056833 0.73 TSHR (0.31) TSHRNPSR1
SCHEMBL23059249 0.73 TSHR (0.31) TSHRNPSR1

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-3744718-A1 HIGHLY ACTIVE CSF1R INHIBITOR COMPOUND Adlai Nortye Biopharma Co., Ltd. (CN) 2020-12-02 EP disclosed