SCHEMBL24861880

SCHEMBL24861880

CC(NC(=O)c1c(C(F)F)nn(C)c1Oc1csc(C(F)(F)F)c1)c1ccc(C(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 16/20 0.72
▸ PTGER2 P43116 3/20 0.72
▸ PHGDH O43175 4/20 0.41

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
SCHEMBL26417331 1.00 PTGER4 (0.72) PTGER4PTGER2PHGDH
SCHEMBL24861807 0.93 PTGER4 (0.62) PTGER4PTGER2PHGDH
SCHEMBL24861730 0.90 PTGER4 (0.72) PTGER4PTGER2PHGDH
SCHEMBL24861806 0.90 PTGER4 (0.72) PTGER4PTGER2PHGDH
SCHEMBL26417363 0.90 PTGER4 (0.72) PTGER4PTGER2PHGDH
SCHEMBL26417308 0.89 PTGER4 (0.73) PTGER4PTGER2PHGDH
SCHEMBL24861881 0.89 PTGER4 (0.73) PTGER4PTGER2PHGDH
SCHEMBL28692145 0.87 PTGER4 (0.74) PTGER4PTGER2
SCHEMBL28692146 0.86 PTGER4 (0.67) PTGER4PTGER2PHGDH
SCHEMBL10122170 0.85 PTGER4 (0.81) PTGER4PTGER2

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-4116291-A1 SYNTHESIS OF NOVEL EP4 ANTAGONIST AND USE IN CANCERS AND INFLAMMATIONS Wuhan Humanwell Innovative Drug Research and Development Center Limited Company (CN) 2023-01-11 — — EP disclosed
Send feedback