SCHEMBL19906170

SCHEMBL19906170

Cc1cc2nc(-c3cccc4nn(C)cc34)sc2c(-c2ccc(Cl)cc2)c1CC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
PDE5A O76074 1/20 0.38
PDE1A P54750 1/20 0.38
PDE1B Q01064 1/20 0.38
PDE4D Q08499 1/20 0.38
PDE7A Q13946 1/20 0.38
PDE1C Q14123 1/20 0.38
PDE3A Q14432 1/20 0.38
PTGDR2 Q9Y5Y4 5/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
USP7 Q93009 1/20 0.38
FABP4 P15090 1/20 0.37
MAPT P10636 2/20 0.36
POLQ O75417 1/20 0.35
AKR1B1 P15121 1/20 0.35
CHRM1 P11229 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
SCHEMBL19906172 0.86 LMNA (0.38) KDM4EPTGDR2LMNASMN1; SMN2ALDH1A1
SCHEMBL19906030 0.85 KDM4E (0.39) KDM4EPDE5APDE1APDE1BPDE4D
SCHEMBL19906316 0.84 KDM4E (0.43) KDM4EPDE5APDE1APDE1BPDE4D
SCHEMBL19906166 0.84 KDM4E (0.40) KDM4EPDE5APDE1APDE1BPDE4D
SCHEMBL19906234 0.84 PTGDR2 (0.38) KDM4EPDE5APDE1APDE1BPDE4D
SCHEMBL19905965 0.83 KDM4E (0.37) KDM4EPDE5APDE1APDE1BPDE4D
SCHEMBL19906327 0.82 PTGDR2 (0.38) KDM4EPDE5APDE1APDE1BPDE4D
SCHEMBL19906324 0.81 KDM4E (0.45) KDM4EPTGDR2LMNASMN1; SMN2ALDH1A1
SCHEMBL19905953 0.81 KDM4E (0.42) KDM4EPDE5APDE1APDE1BPDE4D
SCHEMBL19906377 0.81 PTGDR2 (0.39) KDM4EPDE5APDE1APDE1BPDE4D

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