SCHEMBL8103063

SCHEMBL8103063

Cc1cccc(C)c1-c1cc(C(=O)O)ccc1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 3/20 0.64
TYMS P04818 2/20 0.48
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
PTPN1 P18031 1/20 0.45
TTR P02766 2/20 0.44
NR1H4 Q96RI1 1/20 0.43
GRM1 Q13255 2/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PTPRC P08575 1/20 0.42
GABRP O00591 1/20 0.42
GABRD O14764 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRB1 P18505 1/20 0.42
GABRG2 P18507 1/20 0.42

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
SCHEMBL2744380 0.86 MYC (0.53) MYCTYMSKDM4EALDH1A1TTR
SCHEMBL3558703 0.86 MYC (0.58) MYCTYMSKDM4EALDH1A1HSD17B10
SCHEMBL10782535 0.84 PTPN1 (0.53) MYCKDM4EALDH1A1HSD17B10PTPN1
SCHEMBL526450 0.83 MYC (0.51) MYCTYMSKDM4EALDH1A1HPGD
SCHEMBL629880 0.83 MYC (0.54) MYCKDM4EALDH1A1TTRNR1H4
SCHEMBL27692642 0.81 MYC (0.57) MYCTYMSKDM4EALDH1A1HPGD
SCHEMBL1646864 0.80 MYC (0.50) MYCKDM4EALDH1A1HSD17B10TTR
SCHEMBL17907467 0.79 PARP1 (0.50) MYCTYMS
SCHEMBL28096378 0.79 ALDH1A1 (0.50) MYCKDM4EALDH1A1HSD17B10PTPN1
Benzene SCHEMBL9009251 0.79 KDM4E (0.57) MYCKDM4EALDH1A1HPGDHSD17B10

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-5668224-A TETRAALKYL- OR TRIALKYLAMMONIUM END GROUPS BAYLOR UNIVERSITY 1997-09-16 US claimed
US-6011133-A Laminates of glass or metal and poly(alkylene dicarboxylates) and syntheses thereof BAYLOR UNIVERSITY (US) 2000-01-04 US disclosed
US-5837381-A MULTILAYER PROTECTIVE COATING; WEAR AND CORROSION RESISTANCE UNIV BAYLOR (US) 1998-11-17 US disclosed
US-5668224-A TETRAALKYL- OR TRIALKYLAMMONIUM END GROUPS BAYLOR UNIVERSITY 1997-09-16 US disclosed
US-5451643-A PROTECTIVE COATINGS FOR METALS OR GLASS BAYLOR UNIVERSITY (US) 1995-09-19 US disclosed
WO-1994020296-A1 POLY (ALKYLENE DICARBOXYLATES) AND SYNTHESES THEREOF BAYLOR UNIVERSITY (US) 1994-09-15 WO disclosed