SCHEMBL29914858

SCHEMBL29914858

Cc1[nH]c(=O)c2ccccc2c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ PARP1 P09874 8/20 0.47
▸ KDM4E B2RXH2 5/20 0.47
▸ ALDH1A1 P00352 5/20 0.47
▸ TNKS2 Q9H2K2 3/20 0.47
▸ BLM P54132 3/20 0.47
▸ TNKS O95271 2/20 0.47
▸ PARP15 Q460N3 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ CYP1A2 P05177 2/20 0.47
▸ PMP22 Q01453 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ GPR3 P46089 1/20 0.47
▸ GAA P10253 3/20 0.46
▸ SERPINE1 P05121 2/20 0.43
▸ AURKA O14965 2/20 0.42
▸ AURKB Q96GD4 1/20 0.42
▸ CA12 O43570 1/20 0.41
▸ CA9 Q16790 1/20 0.41

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
SCHEMBL21387271 0.78 PARP1 (0.50) MEN1KMT2APARP1KDM4EALDH1A1
SCHEMBL27159724 0.76 LMNA (0.44) KMT2APARP1LMNACYP1A2HSD17B10
SCHEMBL26018099 0.75 SERPINE1 (0.47) MEN1KMT2APARP1KDM4EALDH1A1
SCHEMBL2673475 0.75 PARP1 (0.47) MEN1KMT2APARP1KDM4EALDH1A1
SCHEMBL29914921 0.75 PARP1 (0.47) MEN1KMT2APARP1KDM4EALDH1A1
SCHEMBL917825 0.75 SERPINE1 (0.58) MEN1KMT2APARP1KDM4EALDH1A1
SCHEMBL5017370 0.74 SERPINE1 (0.55) PARP1TNKS2TNKSSERPINE1MAPT
SCHEMBL29914878 0.74 PARP1 (0.47) MEN1KMT2APARP1
SCHEMBL3228523 0.74 AHR (0.61) MEN1KMT2AKDM4EALDH1A1TNKS2
SCHEMBL27159779 0.72 PDE3B (0.40) MEN1KMT2APARP1KDM4ELMNA

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
WO-2022226665-A1 HALO-SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 — — WO disclosed
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