SCHEMBL30682140

SCHEMBL30682140

COc1cc(Cl)nc2[nH]nc(I)c12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
PRNP P04156 1/20 0.35
PPARG P37231 1/20 0.35
MAPK10 P53779 1/20 0.35
NCOA2 Q15596 1/20 0.35
NCOA1 Q15788 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ADORA3 P0DMS8 2/20 0.34
ADORA1 P30542 2/20 0.34
AMY1A P0DUB6 6/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 2/20 0.32
HSP90AA1 P07900 3/20 0.32
HSP90AB1 P08238 3/20 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
SCHEMBL28412458 1.00 HPGD (0.35) HPGDALDH1A1KDM4EUSP2PRNP
SCHEMBL20389658 0.78 CYP2C19 (0.37) ALDH1A1KDM4ESMN1; SMN2
SCHEMBL16341884 0.76 KDM4E (0.46) HPGDALDH1A1KDM4ESMN1; SMN2MAPT
SCHEMBL6865122 0.74 HTR2A (0.34) HPGDALDH1A1KDM4EUSP2PRNP
SCHEMBL16476633 0.73 KDM4E (0.33) ALDH1A1KDM4EUSP2HSD17B10TDP1
SCHEMBL14769541 0.72 AHR (0.35) KDM4EUSP2SMN1; SMN2NPC1
SCHEMBL15017289 0.71 JAK1 (0.36)
SCHEMBL15016940 0.71 ADORA3 (0.33) ALDH1A1ADORA3ADORA1
SCHEMBL29564268 0.70 CYP1A2 (0.35)
SCHEMBL16052502 0.70 CYP1A2 (0.35)

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-2025264959-A1 SUBSTITUTED PYRAZOLOPYRIDINES AS PHOSPHOINOSIDIDE KINASE (PIK) MODULATORS RECURSION PHARMACEUTICALS, INC. (US) 2025-12-26 WO disclosed
CN-111153899-B Substituted pyridine compound, preparation method and application thereof 四川科伦博泰生物医药股份有限公司 2023-12-01 CN disclosed