SCHEMBL30837164

SCHEMBL30837164

O=C(C=Cc1ccc2nccnc2c1)c1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 4/20 0.70
▸ CXCL12 P48061 4/20 0.57
▸ MAOB P27338 6/20 0.54
▸ MAOA P21397 3/20 0.52
▸ DHODH Q02127 1/20 0.52
▸ CYP1B1 Q16678 1/20 0.51
▸ ABCG2 Q9UNQ0 1/20 0.51
▸ CXCR4 P61073 1/20 0.50

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
SCHEMBL30837219 1.00 CYP3A4 (0.70) CYP3A4CXCL12MAOBMAOADHODH
SCHEMBL30837247 0.96 CYP3A4 (0.75) CYP3A4CXCL12MAOBMAOADHODH
SCHEMBL31574485 0.92 CYP3A4 (0.67) CYP3A4CXCL12MAOBMAOADHODH
SCHEMBL30837206 0.92 CYP3A4 (0.67) CYP3A4CXCL12MAOBMAOADHODH
SCHEMBL31574460 0.89 CYP3A4 (0.62) CYP3A4CXCL12MAOBMAOACYP1B1
SCHEMBL31574555 0.89 CYP3A4 (0.65) CYP3A4CXCL12CYP1B1ABCG2
SCHEMBL30837179 0.89 CYP3A4 (0.65) CYP3A4CXCL12CYP1B1ABCG2
SCHEMBL31574589 0.88 CYP3A4 (0.61) CYP3A4CXCL12MAOBMAOADHODH
SCHEMBL31574595 0.88 CYP3A4 (0.61) CYP3A4CXCL12MAOBMAOADHODH
SCHEMBL30837213 0.88 CYP3A4 (0.61) CYP3A4CXCL12MAOBMAOADHODH

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-4573086-A1 METHANOGEN INHIBITORS Agrizeronz Limited Partnership (NZ) 2025-06-25 — — EP disclosed
WO-2024039250-A1 METHANOGEN INHIBITORS PASTORAL GREENHOUSE GAS RESEARCH LIMITED (NZ) 2024-02-22 — — WO disclosed
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