SCHEMBL5771757

SCHEMBL5771757

Cc1ccc(S(=O)(=O)NC(=O)NCCc2ccc(-n3c(C(C)(C)O)nc4cc(F)c(Cl)cc43)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 9/20 0.53
CA12 O43570 5/20 0.48
CA1 P00915 5/20 0.48
CA2 P00918 5/20 0.48
CA9 Q16790 5/20 0.48
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.39
ALB P02768 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GNRHR P30968 1/20 0.38
TBXA2R P21731 1/20 0.38
PTGER3 P43115 1/20 0.38
PTGER2 P43116 1/20 0.38

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
SCHEMBL1624384 0.91 PTGER4 (0.52) PTGER4CA12CA1CA2CA9
SCHEMBL6897561 0.82 PTGER4 (0.49) PTGER4CA12CA1CA2CA9
SCHEMBL1624676 0.81 PTGER4 (0.70) PTGER4CA12CA1CA2CA9
SCHEMBL1626699 0.80 PTGER4 (0.64) PTGER4CA12CA1CA2CA9
SCHEMBL1625565 0.80 PTGER4 (0.64) PTGER4CA12CA1CA2CA9
SCHEMBL1625246 0.79 PTGER4 (0.65) PTGER4CA12CA1CA2CA9
SCHEMBL1625577 0.79 PTGER4 (0.53) PTGER4CA12CA1CA2CA9
SCHEMBL1625122 0.79 PTGER4 (0.64) PTGER4CA12CA1CA2CA9
SCHEMBL1626191 0.79 PTGER4 (0.64) PTGER4CA12CA1CA2CA9
SCHEMBL1625573 0.79 PTGER4 (0.64) PTGER4CA12CA1CA2CA9

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-1326864-B1 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMA (JP) 2006-03-15 EP disclosed