SCHEMBL4806025

SCHEMBL4806025

CCC[C@]1(CF)CC[C@H](C2CCCCC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 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
SCHEMBL4799667 1.00 ALDH1A1 (0.32) ALDH1A1CYP1A2
SCHEMBL28761260 0.90 ALDH1A1 (0.36) ALDH1A1CYP1A2
SCHEMBL4802426 0.89 CYP1A2 (0.36) CYP1A2
SCHEMBL7151606 0.89 CYP1A2 (0.36) CYP1A2
SCHEMBL28761245 0.86 ALDH1A1 (0.33) ALDH1A1CYP1A2
SCHEMBL28761246 0.83 CYP1A2 (0.35) CYP1A2
SCHEMBL10967777 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8029372 0.82 CYP1A2 (0.38) ALDH1A1CYP1A2
SCHEMBL4803548 0.79
SCHEMBL28655030 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7445818-B2 Matrix liquid crystal display MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-11-04 US disclosed
US-20070275182-A1 Matrix liquid crystal display WEBER GEORG 2007-11-29 US disclosed