SCHEMBL6828580

SCHEMBL6828580

CC(C)(c1ccccc1O)c1ccccc1O.c1cc2cc-2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
TSHR P16473 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
APP P05067 1/20 0.45
HDAC4 P56524 3/20 0.44
HDAC8 Q9BY41 3/20 0.44
HDAC2 Q92769 2/20 0.44
CA2 P00918 1/20 0.41
MEN1 O00255 1/20 0.41
ESR1 P03372 1/20 0.41
KMT2A Q03164 1/20 0.41
CNR1 P21554 2/20 0.40
CNR2 P34972 2/20 0.40
ACMSD Q8TDX5 1/20 0.39
ALOX5 P09917 1/20 0.39
BACE1 P56817 1/20 0.38
HSD17B1 P14061 3/20 0.38
HSD17B2 P37059 3/20 0.38
CYP2C9 P11712 2/20 0.38
HSD17B10 Q99714 2/20 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
SCHEMBL584830 0.87 ALDH1A1 (0.71) ALDH1A1TSHRTDP1CA2MEN1
SCHEMBL29613273 0.87 ALDH1A1 (0.71) ALDH1A1TSHRTDP1CA2MEN1
SCHEMBL146742 0.84 ALDH1A1 (0.68) ALDH1A1TSHRTDP1CA2MEN1
SCHEMBL29599956 0.79 ALDH1A1 (0.56) ALDH1A1TSHRTDP1HDAC4HDAC8
SCHEMBL1347496 0.79 ALDH1A1 (0.56) ALDH1A1TSHRTDP1HDAC4HDAC8
SCHEMBL7716573 0.78 ALDH1A1 (0.60) ALDH1A1TSHRTDP1HDAC4HDAC8
Bicarbonate SCHEMBL4558570 0.78 ALDH1A1 (0.60) ALDH1A1TSHRTDP1CA2ESR1
SCHEMBL985288 0.78 ALDH1A1 (0.47) ALDH1A1TSHRTDP1HDAC4HDAC8
SCHEMBL10614412 0.78 ALDH1A1 (0.48) ALDH1A1TSHRTDP1HDAC4HDAC8
SCHEMBL10705968 0.77 ESR1 (0.46) ALDH1A1TSHRTDP1HDAC4HDAC8

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
EP-1038920-B1 RESIN COMPOSITION TEIJIN CHEMICALS LTD (JP) 2004-12-15 EP disclosed
US-6723824-B1 AROMATIC POLYCARBONATE; HIGH RELIABILITY; REFRACTIVE INDEX ANOMALIES DECREASED BY DECREASING THE NUMBER OF GELLED SUBSTANCES IN THE MOLDING PELLETS; TRANSPARENT TEIJIN CHEMICALS, LTD. (JP) 2004-04-20 US disclosed
EP-1285940-A1 DISC SUBSTRATE FOR OPTICAL USE AND MOLDING MATERIAL THEREFOR Teijin Chemicals, Ltd. (JP) 2003-02-26 EP disclosed
US-6362269-B1 BLEND OF AROMATIC POLYCARBONATE AND STYRENE POLYMER OR AROMATIC POLYESTER TEIJIN CHEMICALS, LTD. (JP) 2002-03-26 US disclosed
US-6355767-B1 BLEND WITH THERMOPLASTIC GRAFT POLYMER COMPRISING VINYL CYANIDE, VINYLAROMATIC AND DIENE COMONOMERS; HEAT RESISTANCE, TRANSPARENCY, NONHYDROLYZING, IMPACT STRENGTH TEIJIN CHEMICALS, LTD (JP) 2002-03-12 US disclosed
EP-1038920-A1 RESIN COMPOSITION Teijin Chemicals, Ltd. (JP) 2000-09-27 EP disclosed