SCHEMBL7632016

SCHEMBL7632016

Nc1ccccc1C12CCC(CC1)C2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.35
MAOB P27338 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
HTR2A P28223 3/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33

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
SCHEMBL21409852 0.86 CD44 (0.34) KDM1AMAOBKDM4EGAAMAPT
SCHEMBL9467542 0.85 KDM1A (0.36) KDM1AMAOBHTR2AGRIN2DGRIN3B
SCHEMBL25125099 0.82 ALDH1A1 (0.48) KDM4EGAAMAPTCYP3A4ALOX15
SCHEMBL3049402 0.78 ALOX5AP (0.37) KDM1AMAOBKDM4EGAAMAPT
SCHEMBL3630843 0.73 SLC6A3 (0.44) KDM1AKDM4EGAAMAPTCYP3A4
SCHEMBL5748698 0.72 ALDH1A1 (0.35) ALDH1A1
SCHEMBL547646 0.72 LMNA (0.41) GAASMN1; SMN2ALDH1A1LMNA
SCHEMBL18297316 0.71 KDM1A (0.38) KDM1AMAOBKDM4EGAAMAPT
SCHEMBL7632195 0.71 GRIN2D (0.31) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL15093129 0.71 ALDH1A1 (0.43) KDM4EGAAMAPTCYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0850427-B1 PHOTOCHROMIC SPIROXAZINES, COMPOSITIONS AND ARTICLES CONTAINING THEM CORNING INC (US) 2002-03-27 EP disclosed
US-6030555-A INCREASES THE COLORABILITY OF THE SPIROXAZINES WITHOUT INCREASING THEIR RESIDUAL COLORATION, WHILE ENSURING EXCELLENT PHOTOSTABILITY; OXAZINE AND INDOLE DYES; POLYMERIC DYES; LENSES; OPTICS CORNING INCORPORATED (US) 2000-02-29 US disclosed
EP-0850427-A4 PHOTOCHROMIC SPIROXAZINES, COMPOSITIONS AND ARTICLES CONTAINING THEM CORNING INC (US) 1998-12-23 EP disclosed
EP-0850427-A1 PHOTOCHROMIC SPIROXAZINES, COMPOSITIONS AND ARTICLES CONTAINING THEM CORNING INCORPORATED (US) 1998-07-01 EP disclosed
WO-1997008573-A1 PHOTOCHROMIC SPIROXAZINES, COMPOSITIONS AND ARTICLES CONTAINING THEM CORNING INCORPORATED (US) 1997-03-06 WO disclosed
EP-0623113-B1 PYRAZOLE CARBOXANILIDE FUNGICIDES MONSANTO CO (US) 1997-03-05 EP disclosed
US-5223526-A For plants MONSANTO COMPANY (US) 1993-06-29 US disclosed
WO-1993011117-A1 PYRAZOLE CARBOXANILIDE FUNGICIDES MONSANTO COMPANY (US) 1993-06-10 WO disclosed