SCHEMBL8378014

SCHEMBL8378014

Cc1cccc(Sc2cc(C)c(O)cc2C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.41
HTR3A P46098 2/20 0.41
IDO1 P14902 1/20 0.41
HPGD P15428 4/20 0.41
MAPT P10636 4/20 0.41
ALOX15 P16050 3/20 0.41
ALOX12 P18054 2/20 0.41
HSD17B10 Q99714 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 2/20 0.41
MAPK1 P28482 2/20 0.41
HIF1A Q16665 2/20 0.41
KDM4E B2RXH2 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
CYP2D6 P10635 1/20 0.41
G6PD P11413 1/20 0.41
CYP2C9 P11712 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL9487673 0.78 HTR1A (0.45) HTR1AHTR3AIDO1HPGDMAPT
SCHEMBL2479249 0.77 ALOX15 (0.59) HPGDMAPTALOX15ALOX12HSD17B10
SCHEMBL29599384 0.77 ALOX15 (0.59) HPGDMAPTALOX15ALOX12HSD17B10
SCHEMBL9236440 0.75 HPGD (0.43) HTR1AHTR3AIDO1HPGDMAPT
SCHEMBL29468631 0.74 ACHE (0.58) HTR1AHTR3AIDO1HPGDMAPT
SCHEMBL29543680 0.74 ACHE (0.58) HTR1AHTR3AIDO1HPGDMAPT
SCHEMBL575896 0.74 ACHE (0.58) HTR1AHTR3AIDO1HPGDMAPT
SCHEMBL3283783 0.74 HTR1A (0.53) HTR1AHTR3AIDO1HPGDMAPT
SCHEMBL9488050 0.73 HTR1A (0.48) HTR1AHTR3AIDO1HPGDMAPT
SCHEMBL9486508 0.71 HTR1A (0.43) HTR1AHTR3AIDO1HPGDMAPT

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
EP-0659801-B1 Polyimide MITSUI CHEMICALS INC (JP) 1999-03-10 EP disclosed
US-5484880-A HEAT RESISTANT POLYMERS FOR APPLIANCES AND INJECTION MOLDED ARTICLES OR FILMS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-01-16 US disclosed
EP-0659801-A1 Polyimide MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-06-28 EP disclosed