SCHEMBL7269797

SCHEMBL7269797

Cc1ccc(-c2cc(O)cc3ccccc23)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.73
MEN1 O00255 2/20 0.73
KMT2A Q03164 2/20 0.73
KDM4E B2RXH2 1/20 0.73
MAPT P10636 1/20 0.73
HPGD P15428 1/20 0.73
MPI P34949 1/20 0.73
NQO2 P16083 1/20 0.50
GPR84 Q9NQS5 2/20 0.49
TLR8 Q9NR97 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2A6 P11509 1/20 0.41
COMT P21964 1/20 0.41
BACE1 P56817 1/20 0.40

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
SCHEMBL3031919 0.85 ALDH1A1 (0.79) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL26367831 0.85 KDM4E (0.92) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL10679583 0.85 KDM4E (1.00) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL28772805 0.82 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL9052405 0.80 ALDH1A1 (0.76) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL31001020 0.80 ALDH1A1 (0.76) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL26367873 0.80 KDM4E (0.70) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL24174147 0.79 GPR84 (0.53) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL28346139 0.79 MEN1 (0.50) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL28404785 0.79 MEN1 (0.53) ALDH1A1MEN1KMT2AKDM4EMAPT

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
US-6630597-B1 Photochromic 6-aryl substituted 3H-naphtho(2, 1-b)pyran compounds, examples of which are naphthopyran compounds having a substituted aryl group at the number 6 carbon atom and certain substituents at the 3-position of the pyran ring TRANSITIONS OPTICAL, INC. 2003-10-07 US disclosed
EP-1042311-A1 PHOTOCHROMIC 6-ARYL SUBSTITUTED 3H-NAPHTHO 2,1-b]PYRANS TRANSITIONS OPTICAL, INC. (US) 2000-10-11 EP disclosed
WO-1999031082-A1 PHOTOCHROMIC 6-ARYL SUBSTITUTED 3H-NAPHTHO[2,1-b]PYRANS TRANSITIONS OPTICAL, INC. (US) 1999-06-24 WO disclosed