SCHEMBL7368881

SCHEMBL7368881

COc1ccc(-c2nc(C)c(-c3cccnc3)n2O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 5/20 0.51
▸ CYP11B1 P15538 4/20 0.51
▸ CYP17A1 P05093 3/20 0.51
▸ CYP19A1 P11511 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ MDM2 Q00987 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ MAPT P10636 3/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ KDM4E B2RXH2 5/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ GLA P06280 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL7372671 0.84 KDM4E (0.46) CYP11B2CYP11B1CYP17A1CYP19A1KMT2A
SCHEMBL7367075 0.84 NPY5R (0.48) CYP11B2CYP11B1CYP19A1MEN1KMT2A
SCHEMBL7370741 0.84 MAPT (0.54) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL7372635 0.83 CYP11B2 (0.52) CYP11B2CYP11B1CYP17A1CYP19A1NPC1
SCHEMBL7370568 0.83 CYP3A4 (0.55) CYP11B2CYP11B1CYP17A1CYP19A1NPC1
SCHEMBL7372213 0.83 CYP19A1 (0.56) CYP11B2CYP11B1CYP19A1MAPTKDM4E
SCHEMBL10567162 0.83 CYP11B2 (0.45) CYP11B2CYP11B1CYP17A1CYP19A1MEN1
SCHEMBL7373609 0.82 MAPT (0.44) CYP11B2CYP11B1CYP19A1MEN1KMT2A
SCHEMBL7372230 0.82 FYN (0.50) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL7370295 0.81 POLB (0.52) KDM4EALDH1A1HPGDSMN1; SMN2HTT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4822805-A ANTIINFLAMMATORY AGENTS, CARDIOTONIC AGENTS, ANTIPLATELET AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-04-18 — — US disclosed
CN-87105680-A Imidazolium compounds and preparation method thereof and comprise the pharmaceutical composition of this compound — 1988-04-27 — — CN disclosed
EP-0257897-A1 Imidazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-03-02 — — EP disclosed
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