SCHEMBL29914853

SCHEMBL29914853

Cc1c[nH]c(=O)c2ccc(B3OC(C)(C)C(C)(C)O3)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.46
WDR77 Q9BQA1 2/20 0.46
CSF1R P07333 1/20 0.41
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
ROCK1 Q13464 1/20 0.38
LPL P06858 9/20 0.37
LIPG Q9Y5X9 9/20 0.37
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
CA12 O43570 1/20 0.35
CA3 P07451 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
EGFR P00533 1/20 0.33

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
SCHEMBL29914854 1.00 PRMT5 (0.46) PRMT5WDR77CSF1RIDO1TDO2
SCHEMBL27159644 1.00 PRMT5 (0.46) PRMT5WDR77CSF1RIDO1TDO2
SCHEMBL2175008 0.84 PRMT5 (0.45) PRMT5WDR77CSF1RIDO1TDO2
SCHEMBL27159987 0.82 CSF1R (0.49) PRMT5WDR77CSF1RIDO1TDO2
SCHEMBL29914790 0.82 CSF1R (0.49) PRMT5WDR77CSF1RIDO1TDO2
SCHEMBL1337551 0.81 ATM (0.41) PRMT5WDR77CSF1RIDO1TDO2
SCHEMBL11000 0.81 ATM (0.41) PRMT5WDR77CSF1RLPLLIPG
SCHEMBL20227582 0.75 PRMT5 (0.46) PRMT5WDR77CSF1RIDO1TDO2
SCHEMBL31304657 0.75 LPL (0.42) PRMT5WDR77CSF1RIDO1TDO2
SCHEMBL2171645 0.75 LPL (0.42) PRMT5WDR77CSF1RIDO1TDO2

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 3 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
WO-2022226668-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 WO disclosed