SCHEMBL25639775

SCHEMBL25639775

COC(=O)[C@@]1(CCCCl)C[C@@H](SC)CN1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ARG2 P78540 3/20 0.32
ARG1 P05089 2/20 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
SCHEMBL25643211 1.00 ARG2 (0.32) ARG2ARG1
SCHEMBL24651733 0.82 ARG2 (0.36) ARG2ARG1
SCHEMBL31442012 0.82 ARG2 (0.46) ARG2ARG1
SCHEMBL24543292 0.82 ARG2 (0.36) ARG2ARG1
Hydrochloric Acid SCHEMBL30923258 0.81 ARG2 (0.45) ARG2ARG1
Hydrochloric Acid SCHEMBL30565848 0.81 ARG2 (0.36) ARG2ARG1
SCHEMBL31441998 0.76 ARG2 (0.31) ARG2ARG1
SCHEMBL24649282 0.74 ARG2 (0.33) ARG2ARG1
SCHEMBL24866607 0.73 CYP4F2 (0.30)
SCHEMBL22208201 0.71 ARG1 (0.44) ARG2ARG1

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-2023103523-A1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUND AS KRAS G12D INHIBITOR 苏州浦合医药科技有限公司 2023-06-15 WO disclosed