SCHEMBL8456941

SCHEMBL8456941

CC[C@H]1CC[C@H](C(=O)OC2CCC(/C=C/C=O)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.36
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL8456945 1.00 CYP19A1 (0.36) CYP19A1MEN1KMT2A
SCHEMBL8456949 1.00 CYP19A1 (0.36) CYP19A1MEN1KMT2A
SCHEMBL8455344 0.85 CYP19A1 (0.40) CYP19A1MEN1KMT2A
SCHEMBL8455346 0.85 CYP19A1 (0.40) CYP19A1MEN1KMT2A
SCHEMBL8458006 0.83 CYP19A1 (0.33) CYP19A1
SCHEMBL8456605 0.83 CYP19A1 (0.33) CYP19A1
SCHEMBL8458009 0.83 CYP19A1 (0.33) CYP19A1
SCHEMBL8456415 0.82 CYP19A1 (0.36) CYP19A1MEN1KMT2A
SCHEMBL8456417 0.82 CYP19A1 (0.36) CYP19A1MEN1KMT2A
SCHEMBL8456413 0.82 CYP19A1 (0.36) CYP19A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5976408-A Acrylonitrile derivative, liquid crystal composition, and liquid crystal display device CHISSO CORPORATION (JP) 1999-11-02 US disclosed