SCHEMBL31266693

SCHEMBL31266693

COC(=O)c1cc(-c2cncs2)nc2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.70
▸ KMT2A Q03164 4/20 0.70
▸ DHODH Q02127 1/20 0.59
▸ KDM4E B2RXH2 5/20 0.58
▸ ALDH1A1 P00352 5/20 0.58
▸ HPGD P15428 3/20 0.56
▸ MAPK1 P28482 2/20 0.56
▸ TDP1 Q9NUW8 2/20 0.56
▸ PLIN1 O60240 1/20 0.56
▸ LMNA P02545 1/20 0.56
▸ GLA P06280 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ PKM P14618 1/20 0.56
▸ PLIN5 Q00G26 1/20 0.56
▸ MCL1 Q07820 1/20 0.56
▸ ABHD5 Q8WTS1 1/20 0.56
▸ MAPT P10636 4/20 0.55
▸ PLA2G2A P14555 3/20 0.55
▸ TP53 P04637 3/20 0.55
▸ GAA P10253 2/20 0.55

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
SCHEMBL31266761 0.86 MEN1 (0.61) MEN1KMT2ADHODHKDM4EALDH1A1
SCHEMBL14518623 0.83 MEN1 (0.72) MEN1KMT2ADHODHKDM4EALDH1A1
SCHEMBL1900020 0.81 MEN1 (0.70) MEN1KMT2ADHODHKDM4EALDH1A1
Hydrochloric Acid SCHEMBL4562712 0.80 MEN1 (0.69) MEN1KMT2ADHODHKDM4EALDH1A1
Bromide SCHEMBL4383984 0.80 MEN1 (0.69) MEN1KMT2ADHODHKDM4EALDH1A1
SCHEMBL31266687 0.79 KLK7 (0.61) MEN1KMT2AKDM4EALDH1A1TDP1
SCHEMBL31266736 0.79 MEN1 (0.46) MEN1KMT2ADHODHKDM4EALDH1A1
SCHEMBL2576382 0.79 KDM4E (0.76) MEN1KMT2ADHODHKDM4EALDH1A1
SCHEMBL28693348 0.79 KDM4E (0.72) MEN1KMT2ADHODHKDM4EALDH1A1
SCHEMBL14518625 0.78 MEN1 (0.66) MEN1KMT2ADHODHKDM4EALDH1A1

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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