SCHEMBL30744772

SCHEMBL30744772

CCOc1cc(C(=O)O)nc2cc(F)ccc12

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.49
PDE10A Q9Y233 2/20 0.46
NAMPT P43490 13/20 0.43
P2RY12 Q9H244 1/20 0.43
TSHR P16473 1/20 0.41
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL4620763 0.90 PDE10A (0.52) ALOX15PDE10ATSHRKDM4E
SCHEMBL9379799 0.86 PKM (0.50) ALOX15KDM4E
SCHEMBL19579748 0.84 ALOX15 (0.49) ALOX15PDE10AP2RY12TSHR
SCHEMBL30744775 0.83 RBP4 (0.46) ALOX15
SCHEMBL31389285 0.83 ALOX15 (0.70) ALOX15P2RY12KDM4E
SCHEMBL18528819 0.83 ALOX15 (0.70) ALOX15P2RY12KDM4E
SCHEMBL19579751 0.83 ALOX15 (0.55) ALOX15TSHRKDM4E
SCHEMBL4620316 0.79 PLA2G2A (0.47) PDE10AP2RY12TSHRKDM4E
SCHEMBL5088569 0.78 DHODH (0.45) ALOX15PDE10AKDM4E
SCHEMBL20515862 0.77 TSHR (0.48) ALOX15TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111295382-B Bridged bicyclic compounds as farnesyl ester X receptor modulators 百时美施贵宝公司 2024-02-02 CN claimed
CN-111295382-B Bridged bicyclic compounds as farnesyl ester X receptor modulators 百时美施贵宝公司 2024-02-02 CN disclosed