SCHEMBL31311094

SCHEMBL31311094

O=C(O)c1cccc(-n2cc3ccccc3n2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 1/20 0.50
▸ ESR2 Q92731 1/20 0.50
▸ MAOA P21397 1/20 0.49
▸ MAOB P27338 1/20 0.49
▸ PARP1 P09874 1/20 0.46
▸ PARP2 Q9UGN5 1/20 0.46
▸ PARP3 Q9Y6F1 1/20 0.46
▸ MEN1 O00255 6/20 0.45
▸ KMT2A Q03164 6/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ GAA P10253 3/20 0.45
▸ MAPT P10636 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ POLB P06746 2/20 0.45
▸ USP2 O75604 1/20 0.45
▸ MYC P01106 1/20 0.45
▸ HSPA1A P0DMV8 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ NR4A1 P22736 1/20 0.45

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
SCHEMBL20765774 0.88 PARP1 (0.52) PLA2G10ESR2PARP1PARP2PARP3
SCHEMBL3668881 0.83 ESR2 (0.50) PLA2G10ESR2MAOAMAOBPARP1
SCHEMBL2979520 0.79 ESR2 (0.62) ESR2PARP1PARP2PARP3MEN1
SCHEMBL28550590 0.78 PARP1 (0.56) ESR2PARP1PARP2PARP3MEN1
SCHEMBL29472998 0.78 PARP1 (0.56) ESR2PARP1PARP2PARP3MEN1
SCHEMBL31632921 0.78 ESR2 (0.49) ESR2MAOAMAOBMEN1KMT2A
SCHEMBL13015506 0.78 MEN1 (0.49) ESR2MEN1KMT2AALDH1A1HSD17B10
SCHEMBL24572943 0.77 ESR2 (0.44) ESR2PARP1PARP2PARP3MEN1
SCHEMBL2263507 0.77 PARP1 (0.76) PARP1PARP2PARP3
SCHEMBL29602757 0.75 ADORA3 (0.57) ESR2MEN1KMT2AKDM4EGAA

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-4731306-A1 CYSTOBACTAMID DERIVATIVES Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2026-04-29 — — EP disclosed
WO-2025003147-A1 CYSTOBACTAMID DERIVATIVES Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2025-01-02 — — WO disclosed
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