SCHEMBL6233097

SCHEMBL6233097

COc1ccc(CN(Cc2ccc(OC)cc2)c2ccc(N(Cc3ccc(OC)cc3)Cc3ccc(OC)cc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APLNR P35414 2/20 0.53
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
CNR2 P34972 4/20 0.50
CNR1 P21554 3/20 0.50
IDO1 P14902 2/20 0.50
PYCR1 P32322 1/20 0.50
CYP2C19 P33261 1/20 0.48
QPCT Q16769 2/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
AGXT P21549 1/20 0.47
LTA4H P09960 1/20 0.47

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
SCHEMBL24455917 0.92 CYP2C19 (0.61) APLNRLMNAMAPTCNR2CNR1
SCHEMBL11776874 0.92 CYP2C19 (0.61) APLNRLMNAMAPTCNR2CNR1
SCHEMBL31308090 0.91 MEN1 (0.51) APLNRLMNAMAPTCNR2CNR1
SCHEMBL24455918 0.91 TDP1 (0.57) APLNRLMNAMAPTCNR2CNR1
SCHEMBL11775688 0.91 CNR2 (0.59) APLNRLMNAMAPTCNR2CNR1
SCHEMBL20870842 0.90 CNR2 (0.57) APLNRLMNAMAPTCNR2CNR1
SCHEMBL7001778 0.90 CYP2C19 (0.63) LMNACNR2CNR1CYP2C19ALDH1A1
SCHEMBL20871181 0.87 CNR2 (0.50) APLNRLMNAMAPTCNR2CNR1
SCHEMBL20871882 0.87 PYCR1 (0.47) APLNRLMNAMAPTCNR2CNR1
SCHEMBL12075881 0.87 LMNA (0.53) APLNRLMNAMAPTIDO1PYCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1060224-B1 NEAR INFRARED-ABSORBING ELECTROCHROMIC COMPOUNDS AND DEVICES COMPRISING SAME GENTEX CORP (US) 2005-05-25 EP disclosed
US-6193912-B1 SOLUTION PHASE ANODIC COMPOUND; ATTENUATION OF SUNLIGHT TRANSMITTANCE THROUGH BUILDING WINDOWS GENTEX CORPORATION 2001-02-27 US disclosed