SCHEMBL27159643

SCHEMBL27159643

CN(C)Cc1cc(B2OC(C)(C)C(C)(C)O2)cc2c1OCCC2

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.31
HTR2C P28335 1/20 0.31
P2RX7 Q99572 1/20 0.31

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
SCHEMBL29914826 1.00 HTR1D (0.31) HTR1DHTR2CP2RX7
SCHEMBL27159789 0.81 LPL (0.31)
SCHEMBL29914852 0.81 LPL (0.31)
SCHEMBL15634931 0.78 LPL (0.36) P2RX7
SCHEMBL30748977 0.78 LPL (0.36) P2RX7
SCHEMBL14746201 0.78 NOTUM (0.40) P2RX7
SCHEMBL31317613 0.76 F11 (0.34) P2RX7
SCHEMBL26625796 0.76 F11 (0.34) P2RX7
SCHEMBL25425144 0.75 KDM4E (0.36)
SCHEMBL30716028 0.75 KDM4E (0.36)

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
EP-4330246-A1 HALO-SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) Ontario Institute for Cancer Research (OICR) (CA) 2024-03-06 EP disclosed
CN-117597336-A Halogen substituted amino aza-heteroaryl compounds as inhibitors of hematopoietic progenitor kinase 1 (HPK 1) 安大略省癌症研究所(OICR) 2024-02-23 CN disclosed