SCHEMBL31266736

SCHEMBL31266736

COC(=O)c1cc(-c2cncs2)cc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ KDM4E B2RXH2 4/20 0.45
▸ ALDH1A1 P00352 4/20 0.45
▸ HPGD P15428 3/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A4 P31645 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.45
▸ DHODH Q02127 1/20 0.43
▸ CD38 P28907 5/20 0.41
▸ MAPT P10636 3/20 0.41
▸ PLA2G2A P14555 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ CASP7 P55210 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL31266813 0.84 DHODH (0.43) MEN1KMT2AKDM4EDHODHTP53
SCHEMBL31266693 0.79 MEN1 (0.70) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL31266837 0.79 CD38 (0.59) MEN1KMT2ACD38
SCHEMBL23306003 0.78 CD38 (0.62) CD38
SCHEMBL28938328 0.78 CD38 (0.60) CD38
SCHEMBL29495183 0.78 CD38 (0.60) CD38
SCHEMBL31484633 0.77 CD38 (0.45) CD38
SCHEMBL1785648 0.76 MEN1 (0.44) MEN1KMT2AKDM4EALDH1A1NPSR1
SCHEMBL29495250 0.76 CD38 (0.60) MEN1KMT2AKDM4ECD38MAPT
SCHEMBL28723076 0.76 CD38 (0.60) MEN1KMT2AKDM4ECD38MAPT

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-4724430-A1 CONDENSED AZINES AS INHIBITORS OF CYCLIC ADP RIBOSE HYDROLASE Flagship Pioneering Innovations VI, LLC (US) 2026-04-15 — — EP disclosed
WO-2024254396-A1 CONDENSED AZINES AS INHIBITORS OF CYCLIC ADP RIBOSE HYDROLASE FLAGSHIP PIONEERING INNOVATIONS, VI, LLC (US) 2024-12-12 — — WO disclosed
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