SCHEMBL24070905

SCHEMBL24070905

CN1C[C@@H](CO)CC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.36
APLNR P35414 1/20 0.36

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
SCHEMBL24069633 1.00 BRD4 (0.36) BRD4APLNR
SCHEMBL26390709 0.79
SCHEMBL5828690 0.78 APLNR (0.33) BRD4APLNR
SCHEMBL9813720 0.76 APLNR (0.44) BRD4APLNR
SCHEMBL19229723 0.74
SCHEMBL25697225 0.72 APLNR (0.32) APLNR
SCHEMBL25697224 0.72 APLNR (0.32) APLNR
SCHEMBL25697222 0.72 APLNR (0.32) APLNR
SCHEMBL4443628 0.71 GAA (0.44) BRD4APLNR
Acetic Acid SCHEMBL6190136 0.71 BRD4 (0.30) BRD4

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-2021239058-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF 劲方医药科技(上海)有限公司 2021-12-02 WO disclosed