SCHEMBL31546295

SCHEMBL31546295

CC(C)(O)c1cc(C2CC2)n(-c2ccc(Br)cc2)n1

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CRACR2A Q9BSW2 15/20 0.43
▸ ORAI1 Q96D31 4/20 0.40
▸ PPARA Q07869 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
SCHEMBL626659 0.83 CRACR2A (0.56) CRACR2AORAI1
SCHEMBL30677244 0.83 CRACR2A (0.43) CRACR2AORAI1
SCHEMBL30677147 0.78 PTGS2 (0.41) —
SCHEMBL31560032 0.78 MAPT (0.51) CRACR2APPARA
SCHEMBL31546269 0.69 GAA (0.46) —
SCHEMBL1880912 0.69 CRACR2A (0.56) CRACR2AORAI1
SCHEMBL30785286 0.69 CRACR2A (0.56) CRACR2AORAI1
SCHEMBL20006306 0.69 CRACR2A (0.61) CRACR2AORAI1
SCHEMBL20006304 0.69 CRACR2A (0.53) CRACR2AORAI1
SCHEMBL1668441 0.68 CRACR2A (0.65) CRACR2AORAI1

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
CN-119731178-A USP1 inhibitors and uses thereof 福马治疗有限公司 2025-03-28 — — CN disclosed
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