SCHEMBL19906287

SCHEMBL19906287

Cc1cc2nc(-c3ccnc(-c4cnn(C)c4)c3)sc2c(-c2ccc(Cl)cc2)c1CC(=O)O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.37
FGFR3 P22607 1/20 0.37
KDM4E B2RXH2 2/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.36
EGFR P00533 10/20 0.35
BRD4 O60885 1/20 0.35
CCNC P24863 1/20 0.34
CDK8 P49336 1/20 0.34
AURKB Q96GD4 1/20 0.34
CSF1R P07333 1/20 0.34

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
SCHEMBL19905844 0.90 PTGDR2 (0.35) KDM4EPTGDR2MEN1ALDH1A1KMT2A
SCHEMBL19905882 0.87 KDM4E (0.41) KDM4EPTGDR2MEN1ALDH1A1KMT2A
SCHEMBL19906288 0.87 CSF1R (0.35) KDRFGFR3KDM4EPTGDR2MEN1
SCHEMBL19906178 0.87 PTGDR2 (0.35) KDM4EPTGDR2MEN1ALDH1A1KMT2A
SCHEMBL17547144 0.87 PTGDR2 (0.35) KDM4EPTGDR2MEN1ALDH1A1KMT2A
SCHEMBL19905859 0.86 PTGDR2 (0.37) KDM4EPTGDR2MEN1ALDH1A1KMT2A
SCHEMBL17547166 0.86 PTGDR2 (0.38) KDM4EPTGDR2MEN1ALDH1A1KMT2A
SCHEMBL19906317 0.86 PTGDR2 (0.35) KDM4EPTGDR2MEN1ALDH1A1KMT2A
SCHEMBL19905848 0.85 KDM4E (0.36) KDM4EPTGDR2MEN1ALDH1A1KMT2A
SCHEMBL19906377 0.85 PTGDR2 (0.39) KDM4EPTGDR2MEN1ALDH1A1KMT2A

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-3070081-B1 BENZOTHIAZOL-6-YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION GILEAD SCIENCES INC (US) 2018-02-28 EP disclosed