SCHEMBL7269790

SCHEMBL7269790

OC#CC(O)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 4/20 0.44
APOBEC3A P31941 2/20 0.44
APOBEC3G Q9HC16 2/20 0.44
PABPC1 P11940 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.42
TSHR P16473 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
CHRM2 P08172 2/20 0.36
CHRM3 P20309 2/20 0.36
KCNN4 O15554 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
SCHEMBL1758086 0.87 ALDH1A1 (0.53) ALDH1A1KDM4EAPOBEC3AAPOBEC3GPABPC1
SCHEMBL414397 0.82 ALDH1A1 (0.50) ALDH1A1KDM4EAPOBEC3AAPOBEC3GPABPC1
SCHEMBL11048505 0.78 ALDH1A1 (0.47) ALDH1A1KDM4EAPOBEC3AAPOBEC3GPABPC1
SCHEMBL31261832 0.78 KDM4E (0.47) ALDH1A1KDM4EAPOBEC3AAPOBEC3GPABPC1
SCHEMBL11216416 0.78 ALDH1A1 (0.52) ALDH1A1KDM4EAPOBEC3AAPOBEC3GPABPC1
SCHEMBL2241808 0.76 APP (0.48) ALDH1A1KDM4EAPOBEC3AAPOBEC3GPABPC1
SCHEMBL9626191 0.76 ALDH1A1 (0.46) ALDH1A1KDM4EAPOBEC3AAPOBEC3GPABPC1
SCHEMBL11573251 0.75 ALDH1A1 (0.35) ALDH1A1KDM4EAPOBEC3AAPOBEC3GPABPC1
SCHEMBL9547910 0.75 ALDH1A1 (0.58) ALDH1A1KDM4EAPOBEC3AAPOBEC3GPABPC1
SCHEMBL25148807 0.73 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1CYP2C19CHRM2

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