SCHEMBL12792017

SCHEMBL12792017

Cc1cccc(Sc2ccc(C)c(C)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.44
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
KMT2A Q03164 1/20 0.41
HTR2C P28335 1/20 0.40
HTR6 P50406 1/20 0.40
HTR1A P08908 4/20 0.40
HTR3A P46098 4/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C9 P11712 2/20 0.40
IDO1 P14902 1/20 0.40
GRM5 P41594 1/20 0.39
GFER P55789 2/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL26717446 0.88 ACHE (0.44) ACHEALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL10710202 0.87 ACHE (0.52) ACHEALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL575896 0.87 ACHE (0.58) ACHEALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL29468631 0.87 ACHE (0.58) ACHEALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL29543680 0.87 ACHE (0.58) ACHEALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL47860 0.84 ALDH1A1 (0.50) ACHEALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL30832958 0.84 ALDH1A1 (0.50) ACHEALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL822376 0.83 ACHE (0.48) ACHEALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL10007323 0.83 ALDH1A1 (0.47) ACHEALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL31038384 0.83 ACHE (0.48) ACHEALDH1A1HPGDMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8821617-B2 Polyimide-co-polybenzoxazole copolymer, preparation method thereof, and gas separation membrane comprising the same INDUSTRY-UNIVERSITY COOPERATION FOUNDATION, HANYANG UNIVERSITY (KR) 2014-09-02 US disclosed
US-20110065823-A1 POLYIMIDE-CO-POLYBENZOXAZOLE COPOLYMER, PREPARATION METHOD THEREOF, AND GAS SEPARATION MEMBRANE COMPRISING THE SAME Industry-University Cooperation Foundation, Hanyan g University (KR) 2011-03-17 US disclosed
US-20110065823-A1 POLYIMIDE-CO-POLYBENZOXAZOLE COPOLYMER, PREPARATION METHOD THEREOF, AND GAS SEPARATION MEMBRANE COMPRISING THE SAME Industry-University Cooperation Foundation, Hanyan g University (KR) 2011-03-17 US disclosed
US-20100099804-A1 POLYMER COMPOUNDS AND A PREPARATION METHOD THEREOF INDUSTRY-UNIVERSITY COOPERATION FOUNDATION, HANYANG UNIVERSITY (KR) 2010-04-22 US disclosed
US-20100099804-A1 POLYMER COMPOUNDS AND A PREPARATION METHOD THEREOF INDUSTRY-UNIVERSITY COOPERATION FOUNDATION, HANYANG UNIVERSITY (KR) 2010-04-22 US disclosed
WO-2009107889-A1 POLYIMIDE-CO-POLYBENZOXAZOLE COPOLYMER, PREPARATION METHOD THEREOF, AND GAS SEPARATION MEMBRANE COMPRISING THE SAME INDUSTRY-UNIVERSITY COOPERATION FOUNDATION, HANYANG UNIVERSITY (KR) 2009-09-03 WO disclosed