SCHEMBL31459169

SCHEMBL31459169

CC1CC(C(=O)NN)(c2cc(Cl)nc(OCC(F)F)c2)C1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ S1PR2 O95136 2/20 0.34
▸ BACE1 P56817 2/20 0.32
▸ ACACB O00763 4/20 0.32

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
SCHEMBL31459105 0.87 S1PR2 (0.34) S1PR2BACE1ACACB
SCHEMBL31459244 0.82 S1PR2 (0.34) S1PR2
SCHEMBL31275111 0.75 S1PR2 (0.39) S1PR2
SCHEMBL31274972 0.75 S1PR2 (0.38) S1PR2
SCHEMBL31274670 0.73 S1PR2 (0.40) S1PR2
SCHEMBL31459041 0.73 — —
SCHEMBL31459084 0.69 ACACB (0.37) ACACB
SCHEMBL25411583 0.69 CCR2 (0.36) S1PR2
SCHEMBL25414277 0.68 LMNA (0.36) S1PR2
SCHEMBL31459164 0.67 ALDH1A1 (0.38) S1PR2

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
WO-2025067227-A1 PREPARATION METHOD FOR CBL-B REGULATOR, AND USE 浙江华海药业股份有限公司 2025-04-03 — — WO disclosed
Send feedback