SCHEMBL8099779

SCHEMBL8099779

CCCCCCCC1CCC(c2ccc(C(CCCC)c3ccc(N)cc3)cc2)(c2ccc(C(CCCC)c3ccc(N)cc3)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 16/20 0.39
GRM2 Q14416 1/20 0.36
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP1A2 P05177 1/20 0.33
NFE2L2 Q16236 1/20 0.32

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
SCHEMBL8101519 1.00 CYP19A1 (0.39) CYP19A1GRM2ALDH1A1L3MBTL1CYP1A2
SCHEMBL8101286 1.00 CYP19A1 (0.39) CYP19A1GRM2ALDH1A1L3MBTL1CYP1A2
SCHEMBL8086245 1.00 CYP19A1 (0.39) CYP19A1GRM2ALDH1A1L3MBTL1CYP1A2
SCHEMBL8095607 1.00 CYP19A1 (0.39) CYP19A1GRM2ALDH1A1L3MBTL1CYP1A2
SCHEMBL8099086 1.00 CYP19A1 (0.39) CYP19A1GRM2ALDH1A1L3MBTL1CYP1A2
SCHEMBL8101568 1.00 CYP19A1 (0.39) CYP19A1GRM2ALDH1A1L3MBTL1CYP1A2
SCHEMBL8101151 0.99 CYP19A1 (0.38) CYP19A1GRM2ALDH1A1L3MBTL1CYP1A2
SCHEMBL8095609 0.98 CYP19A1 (0.39) CYP19A1GRM2ALDH1A1L3MBTL1CYP1A2
SCHEMBL8085975 0.98 CYP19A1 (0.39) CYP19A1GRM2ALDH1A1L3MBTL1CYP1A2
SCHEMBL8086991 0.98 CYP19A1 (0.39) CYP19A1GRM2ALDH1A1L3MBTL1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
US-5807961-A Polyamic acid, polyimide film and liquid crystal aligning film and liquid crystal display element using the formers CHISSO CORPORATION (JP) 1998-09-15 US disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 US disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed