SCHEMBL10000285

SCHEMBL10000285

Cc1ccc(Oc2ccc(NC(=O)c3ccc4c(c3)CN(C)C4)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.52
NPC1 O15118 10/20 0.52
SMN1; SMN2 Q16637 4/20 0.51
TMPRSS2 O15393 1/20 0.49
NFKB1 P19838 2/20 0.48
NFKB2 Q00653 2/20 0.48
RELA Q04206 2/20 0.48
TSHR P16473 2/20 0.48
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
HPGD P15428 2/20 0.47
PNLIP P16233 1/20 0.47
NAMPT P43490 2/20 0.47
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL10000286 0.92 RAB9A (0.59) RAB9ANPC1SMN1; SMN2TMPRSS2NFKB1
SCHEMBL7591319 0.77 ALDH1A1 (0.57) RAB9ANPC1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL6295061 0.76 RAB9A (0.69) RAB9ANPC1SMN1; SMN2TMPRSS2NFKB1
SCHEMBL15214322 0.76 NPC1 (0.71) RAB9ANPC1SMN1; SMN2TSHRALDH1A1
SCHEMBL6293540 0.75 NR1H4 (0.55) RAB9ANPC1SMN1; SMN2TMPRSS2NFKB1
SCHEMBL13306317 0.75 PGR (0.71) RAB9ANPC1SMN1; SMN2NFKB1NFKB2
SCHEMBL27256453 0.74 MMP13 (0.81) RAB9ANPC1SMN1; SMN2TSHRALDH1A1
SCHEMBL14363134 0.74 PGR (0.79) RAB9ANPC1SMN1; SMN2TSHRALDH1A1
SCHEMBL15164871 0.73 NPC1 (0.68) RAB9ANPC1SMN1; SMN2ALDH1A1TP53
SCHEMBL7306324 0.73 NPC1 (0.78) RAB9ANPC1SMN1; SMN2TMPRSS2NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160367935-A1 DEFECT-FREE CARBON MOLECULAR SIEVE MEMBRANES WITH ENHANCED SELECTIVITY AND AGING RESISTANCE AND THE METHOD OF MAKING THE SAME L'Air Liquide, Société Anonyme pour l'Etude et l'Exploitation des Procédés Georges Claude (FR) 2016-12-22 US disclosed
US-20160151746-A1 COMPOSITE CARBON MOLECULAR SIEVE MEMBRANES HAVING ANTI-SUBSTRUCTURE COLLAPSE PARTICLES LOADED IN A CORE THEREOF AMERICAN AIR LIQUIDE, INC. 2016-06-02 US disclosed
US-8101009-B2 Separation membrane by controlled annealing of polyimide polymers L'AIR LIQUIDE SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) 2012-01-24 US disclosed
US-20090227744-A1 Separation Membrane by Controlled Annealing of Polyimide Polymers L'AIR LIQUIDE SOCIETE ANONYME POUR L'ETUDE ET L'EXPLOITATION DES PROCEDES GEORGES CLAUDE (FR) 2009-09-10 US disclosed