SCHEMBL25196232

SCHEMBL25196232

Cc1ncsc1-c1ncc(C(C)N)cn1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
PKM P14618 1/20 0.31
VHL P40337 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL24514612 0.79 ROCK1 (0.33) VHL
SCHEMBL25217414 0.79 ROCK1 (0.33) VHL
SCHEMBL17946900 0.76 VHL (0.46) VHL
SCHEMBL17954383 0.76 VHL (0.46) VHL
SCHEMBL31152781 0.76 VHL (0.46) VHL
Hydrochloric Acid SCHEMBL17941059 0.75 VHL (0.44) VHL
Hydrochloric Acid SCHEMBL20214476 0.75 VHL (0.44) VHL
Hydrochloric Acid SCHEMBL21855145 0.73 VHL (0.43) VHL
SCHEMBL25201653 0.70 VHL (0.43) KDM4EPKMVHLMEN1ALDH1A1
SCHEMBL25207224 0.70

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-2023093728-A1 BRM SELECTIVE DEGRADATION AGENT COMPOUND AND USE THEREOF 江苏先声药业有限公司 2023-06-01 WO disclosed
WO-2023093728-A1 BRM SELECTIVE DEGRADATION AGENT COMPOUND AND USE THEREOF 江苏先声药业有限公司 2023-06-01 WO disclosed