SCHEMBL3694385

SCHEMBL3694385

CCCCC[C@H]1CC[C@H](c2ccc(-c3ccc(C(=O)Nc4ccc(-c5ccc6c7c(c8c(c6c5)-c5cc(F)cc(F)c5C8(C)C)C=CC(c5ccc(F)cc5)(c5ccc(N6CCCCC6)cc5)O7)cc4)cc3)cc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
TP53 P04637 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
HTR2A P28223 2/20 0.33
DRD3 P35462 2/20 0.33
HRH3 Q9Y5N1 1/20 0.32
CCR5 P51681 4/20 0.32
MAPT P10636 3/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
CXCR1 P25024 1/20 0.32
CXCR2 P25025 1/20 0.32
MCHR1 Q99705 2/20 0.31
CTNNB1 P35222 3/20 0.31
TCF7L2 Q9NQB0 3/20 0.31
TSHR P16473 1/20 0.31
MEN1 O00255 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
SCHEMBL12553396 1.00 NPC1 (0.36) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL1962065 0.93 MCHR1 (0.34) SMN1; SMN2HTR2ADRD3MAPTMCHR1
SCHEMBL12553391 0.93 MCHR1 (0.34) SMN1; SMN2HTR2ADRD3MAPTMCHR1
SCHEMBL29910323 0.89 RAB9A (0.35) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL12573705 0.89 RAB9A (0.35) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL1333738 0.89 RAB9A (0.35) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL12553379 0.88 NPC1 (0.33) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL1962387 0.88 FGFR1 (0.33) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL12581569 0.88 FGFR1 (0.33) NPC1RAB9ATP53SMN1; SMN2ALOX15
SCHEMBL12553495 0.87 NPC1 (0.34) NPC1RAB9ATP53SMN1; SMN2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2718754-B1 POLARIZING PHOTOCHROMIC ARTICLES TRANSITIONS OPTICAL INC (US) 2024-01-24 EP disclosed
EP-2969499-B1 METHOD OF PREPARING PHOTOCHROMIC-DICHROIC FILMS HAVING REDUCED OPTICAL DISTORTION TRANSITIONS OPTICAL INC (US) 2021-12-08 EP disclosed
EP-2969468-B1 METHOD OF PREPARING PHOTOCHROMIC-DICHROIC FILMS HAVING REDUCED OPTICAL DISTORTION TRANSITIONS OPTICAL INC (US) 2020-12-23 EP disclosed
EP-3045971-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS Transitions Optical, Inc. (US) 2016-07-20 EP disclosed
EP-2652553-B1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL INC (US) 2016-04-06 EP disclosed
US-9030740-B2 Photochromic article having at least partially crossed polarized photochromic-dichroic and fixed-polarized layers TRANSITIONS OPTICAL, INC. (US) 2015-05-12 US disclosed
US-20140265010-A1 METHOD OF PREPARING PHOTOCHROMIC-DICHROIC FILMS HAVING REDUCED OPTICAL DISTORTION TRANSITIONS OPTICAL LIMITED (IE) 2014-09-18 US disclosed
US-20140264979-A1 METHOD OF PREPARING PHOTOCHROMIC-DICHROIC FILMS HAVING REDUCED OPTICAL DISTORTION TRANSITIONS OPTICAL LIMITED (IE) 2014-09-18 US disclosed
US-20140078583-A1 Photochromic Article Having At Least Partially Crossed Polarized Photochromic-Dichroic And Fixed-Polarized Layers TRANSITIONS OPTICAL, INC. (US) 2014-03-20 US disclosed
US-8649081-B1 Photochromic article having two at least partially crossed photochromic-dichroic layers TRANSITIONS OPTICAL, INC. (US) 2014-02-11 US disclosed
US-8545015-B2 Polarizing photochromic articles TRANSITIONS OPTICAL, INC. (US) 2013-10-01 US disclosed
US-20120120473-A1 POLARIZING PHOTOCHROMIC ARTICLES TRANSITIONS OPTICAL, INC. (US) 2012-05-17 US disclosed