SCHEMBL9350718

SCHEMBL9350718

CCCCCCCCCCCC1CCCC(c2cc(C)c(Oc3ccc(N)cc3)c(C)c2)(c2cc(C)c(Oc3ccc(N)cc3)c(C)c2)C1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 11/20 0.35
NFE2L2 Q16236 1/20 0.33
GRM2 Q14416 1/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2C8 P10632 1/20 0.31
S1PR3 Q99500 1/20 0.31
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL9350055 1.00 CYP19A1 (0.35) CYP19A1NFE2L2GRM2CYP3A4CYP2C8
SCHEMBL9349564 1.00 CYP19A1 (0.35) CYP19A1NFE2L2GRM2CYP3A4CYP2C8
SCHEMBL9350741 1.00 CYP19A1 (0.35) CYP19A1NFE2L2GRM2CYP3A4CYP2C8
SCHEMBL9353541 1.00 CYP19A1 (0.35) CYP19A1NFE2L2GRM2CYP3A4CYP2C8
SCHEMBL9350038 1.00 CYP19A1 (0.35) CYP19A1NFE2L2GRM2CYP3A4CYP2C8
SCHEMBL9353564 1.00 CYP19A1 (0.35) CYP19A1NFE2L2GRM2CYP3A4CYP2C8
SCHEMBL9349572 1.00 CYP19A1 (0.35) CYP19A1NFE2L2GRM2CYP3A4CYP2C8
SCHEMBL9353468 1.00 CYP19A1 (0.35) CYP19A1NFE2L2GRM2CYP3A4CYP2C8
SCHEMBL9350014 1.00 CYP19A1 (0.35) CYP19A1NFE2L2GRM2CYP3A4CYP2C8
SCHEMBL9353589 1.00 CYP19A1 (0.35) CYP19A1NFE2L2GRM2CYP3A4CYP2C8

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
EP-0368604-B1 New diamino and dinitro compounds and a process for preparing the diamino compounds CHISSO CORP (JP) 1994-08-31 EP disclosed
US-5008456-A Chemical intermediates for polyamides and polyimides CHISSO CORPORATION (JP) 1991-04-16 US disclosed
EP-0368604-A2 New diamino and dinitro compounds and a process for preparing the diamino compounds CHISSO CORPORATION (JP) 1990-05-16 EP disclosed