SCHEMBL15214872

SCHEMBL15214872

CCCCCC1CCC(c2ccc(-c3ccc(OC(=O)C4CCC(C(=O)Nc5ccc(-c6cc7c8c(c9c(c7cc6OC)OC(c6ccccc6)(c6ccc(N7CCOCC7)cc6)C=C9)C(C)(C)c6c-8cc(C(F)(F)F)cc6C(F)(F)F)c(C)c5)CC4)cc3)cc2)CC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.32
KDR P35968 1/20 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
SCHEMBL12553432 0.97 GBA1 (0.32) GBA1
SCHEMBL1962311 0.94
SCHEMBL12553427 0.94
SCHEMBL1962309 0.94
SCHEMBL9973017 0.93 RAF1 (0.34)
SCHEMBL12581578 0.92 GBA1 (0.32) GBA1
SCHEMBL12581596 0.91
SCHEMBL3701114 0.91
SCHEMBL15214826 0.91 MAPK14 (0.34)
SCHEMBL12553429 0.89 BRAF (0.33) KDR

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
EP-3045971-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS Transitions Optical, Inc. (US) 2016-07-20 EP disclosed
US-8518546-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2013-08-27 US disclosed