SCHEMBL5433761

SCHEMBL5433761

CCC(c1nc(C#N)nc(C#N)n1)n1ccnc1.O=c1[nH]c(=O)[nH]c(=O)[nH]1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CYP17A1 P05093 15/20 0.40
▸ CYP11B1 P15538 2/20 0.38
▸ CYP11B2 P19099 2/20 0.38
▸ CYP19A1 P11511 2/20 0.38
▸ CYP3A4 P08684 1/20 0.36

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
SCHEMBL1252537 0.82 CYP11B1 (0.42) CYP17A1CYP11B1CYP11B2CYP3A4
SCHEMBL5367784 0.71 CYP17A1 (0.49) CYP17A1CYP11B1CYP11B2CYP3A4
SCHEMBL10887234 0.62 CYP19A1 (0.41) CYP17A1CYP11B1CYP11B2CYP19A1CYP3A4
SCHEMBL5297627 0.62 CYP17A1 (0.82) CYP17A1CYP11B1CYP11B2CYP19A1CYP3A4
SCHEMBL14815681 0.61 CYP17A1 (0.50) CYP17A1CYP11B1CYP11B2CYP19A1CYP3A4
SCHEMBL27793815 0.61 CYP17A1 (0.50) CYP17A1CYP11B1CYP11B2CYP3A4
SCHEMBL9784379 0.61 CYP19A1 (0.66) CYP17A1CYP19A1
Water SCHEMBL28822856 0.59 CYP17A1 (0.44) CYP17A1CYP19A1
SCHEMBL1835183 0.59 — —
SCHEMBL11247883 0.59 CYP17A1 (0.55) CYP17A1CYP11B1CYP11B2CYP19A1

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
US-7208062-B2 Method of producing multilayer printed wiring board AJINOMOTO CO., INC. (JP) 2007-04-24 — — US disclosed
US-20050005437-A1 Adhesive film for use in multilayer printed wiring board and method of producing multilayer printed wiring board AJINOMOTO CO., INC. (JP) 2005-01-13 — — US disclosed
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