SCHEMBL8102552

SCHEMBL8102552

CCCCCCC1CCC(c2ccc(C(CC)c3ccc(N)cc3C)cc2)(c2ccc(C(CC)c3ccc(N)cc3C)cc2)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 7/20 0.33
GRM2 Q14416 2/20 0.31

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
SCHEMBL8099184 1.00 CYP19A1 (0.33) CYP19A1GRM2
SCHEMBL8093357 1.00 CYP19A1 (0.33) CYP19A1GRM2
SCHEMBL8095978 1.00 CYP19A1 (0.33) CYP19A1GRM2
SCHEMBL8087719 1.00 CYP19A1 (0.33) CYP19A1GRM2
SCHEMBL8092149 1.00 CYP19A1 (0.33) CYP19A1GRM2
SCHEMBL8092279 1.00 CYP19A1 (0.33) CYP19A1GRM2
SCHEMBL8096457 0.99 CYP19A1 (0.32) CYP19A1
SCHEMBL8085223 0.96 CYP19A1 (0.31) CYP19A1
SCHEMBL8098002 0.94 CYP19A1 (0.32) CYP19A1GRM2
SCHEMBL8094481 0.94 CYP19A1 (0.32) CYP19A1GRM2

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-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP 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