SCHEMBL31497601

SCHEMBL31497601

Cc1cc(C(F)(F)F)nn1-c1ccc(CO)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
STIM1 Q13586 2/20 0.48
ORAI1 Q96D31 2/20 0.48
PTGS2 P35354 16/20 0.46
F10 P00742 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
SCHEMBL25465405 0.86 STIM1 (0.48) STIM1ORAI1PTGS2F10
SCHEMBL31504003 0.86 STIM1 (0.48) STIM1ORAI1PTGS2F10
SCHEMBL31155882 0.83 PTGS2 (0.49) STIM1ORAI1PTGS2
SCHEMBL22122069 0.80 PTGS2 (0.55) STIM1ORAI1PTGS2
SCHEMBL31497594 0.77 ALDH1A1 (0.47) STIM1ORAI1PTGS2
SCHEMBL18163944 0.76 PTGS2 (0.55) STIM1ORAI1PTGS2
SCHEMBL25180836 0.76 STIM1 (0.54) STIM1ORAI1PTGS2
SCHEMBL31497624 0.76 STIM1 (0.46) STIM1ORAI1PTGS2
SCHEMBL25181380 0.76 STIM1 (0.46) STIM1ORAI1PTGS2
SCHEMBL30443166 0.76 STIM1 (0.54) STIM1ORAI1PTGS2

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
WO-2025129135-A2 COMPOSITIONS COMPRISING USP1 INHIBITORS AND METHODS OF USING THE SAME EIKON THERAPEUTICS, INC. (US) 2025-06-19 WO disclosed
WO-2025095751-A1 NOVEL COMPOUND, AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER COMPRISING SAME 현대약품 주식회사 2025-05-08 WO disclosed