SCHEMBL7100996

SCHEMBL7100996

CCCCC(CC)COc1ccc(-c2nc(Cl)nc(-c3ccc(OCC(CC)CCCC)cc3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.46
RAB9A P51151 5/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HSD17B10 Q99714 2/20 0.46
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 7/20 0.38
MAPT P10636 3/20 0.38
CYP2C19 P33261 2/20 0.38
HPGD P15428 2/20 0.38
CYP1A2 P05177 1/20 0.38
GAA P10253 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP3A4 P08684 3/20 0.37
MAPK1 P28482 2/20 0.37
CA2 P00918 1/20 0.37
CYP2D6 P10635 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL4430185 0.93 NPC1 (0.44) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL17212283 0.88 NPC1 (0.40) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL7098517 0.87 ALDH1A1 (0.40) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL7097844 0.87 LTA4H (0.44) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL20357876 0.83 CYP3A4 (0.47) HSD17B10ALDH1A1CYP2C19CYP1A2CYP19A1
SCHEMBL7097913 0.82 LMNA (0.39) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL17831410 0.82 LMNA (0.39) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E
SCHEMBL1356320 0.81 ALDH1A1 (0.50) HSD17B10ALDH1A1CYP3A4MAPK1CA2
SCHEMBL1357035 0.81 ALDH1A1 (0.50) HSD17B10ALDH1A1CYP3A4MAPK1CA2
SCHEMBL28651582 0.81 KMT2A (0.43) NPC1RAB9ASMN1; SMN2HSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0743309-B1 o-Hydroxyphenyl-s-triazines as UV stabilisers CIBA SC HOLDING AG (CH) 2003-09-10 EP disclosed
EP-0654469-B1 Stabilised polymers containing o-hydroxyphenyl-s-triazines CIBA SC HOLDING AG (CH) 2001-08-22 EP disclosed
US-5591850-A STABILIZERS FOR TEXTILE FIBERS, COSMETIC SUNSCREENS CIBA-GEIGY CORPORATION (US) 1997-01-07 US disclosed
EP-0743309-A1 o-Hydroxyphenyl-s-triazines as UV stabilisers CIBA-GEIGY AG (CH) 1996-11-20 EP disclosed
EP-0654469-A1 O-Hydroxyphenyl-s-triazines as stabilisers for polymers CIBA-GEIGY AG (CH) 1995-05-24 EP disclosed