SCHEMBL13680469

SCHEMBL13680469

Cc1ccc(-c2ccc(C)o2)cn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 3/20 0.42
GAA P10253 2/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
HPGDS O60760 1/20 0.42
TDP1 Q9NUW8 1/20 0.39
GSK3B P49841 4/20 0.38
ELANE P08246 1/20 0.38
MAPT P10636 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALOX15 P16050 1/20 0.38
TDO2 P48775 1/20 0.37
PKM P14618 2/20 0.37

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
SCHEMBL13680455 0.81 CYP2A6 (0.45) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL13680715 0.79 TDP1 (0.42) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL13680457 0.78 MAPT (0.49) NPC1RAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL13680505 0.78 APP (0.49) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL23197679 0.78 TDP1 (0.56) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL13680514 0.77 TRPV4 (0.43) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL13681286 0.77 ALDH1A1 (0.41) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL13680711 0.76 ALDH1A1 (0.39) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL13680718 0.76 ALDH1A1 (0.39) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL13680568 0.75 P4HTM (0.44) KDM4EALDH1A1LMNATSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2922137-A1 PHOTOELECTRIC CONVERSION ELEMENT, DYE-SENSITIZED SOLAR CELL, METAL COMPLEX DYE, DYE SOLUTION, DYE-ADSORBED ELECTRODE, AND METHOD FOR MANUFACTURING DYE-SENSITIZED SOLAR CELL FUJIFILM Corporation (JP) 2015-09-23 EP disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed