SCHEMBL50716

SCHEMBL50716

CCc1ccc(Cc2ccc(CC)cc2O)c(O)c1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.64
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
ALOX5 P09917 2/20 0.44
HSPA5 P11021 2/20 0.41
BACE1 P56817 1/20 0.41
DAO P14920 1/20 0.41
POLB P06746 1/20 0.41
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40

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
SCHEMBL593741 0.88 TRPA1 (0.67) TRPA1MAPTBACE1DAOPOLB
SCHEMBL12806929 0.86 TRPA1 (0.53) TRPA1MAPTMEN1KMT2ACA1
SCHEMBL11648149 0.84 TRPA1 (0.61) TRPA1MAPTALOX5BACE1DAO
SCHEMBL22500692 0.83 MAPT (0.53) TRPA1MAPTMEN1KMT2AALOX5
SCHEMBL14646868 0.83 TRPA1 (0.59) TRPA1MAPTBACE1DAOPOLB
SCHEMBL5167232 0.83 TRPA1 (0.59) TRPA1MAPTMEN1KMT2AALOX5
SCHEMBL30903489 0.83 TRPA1 (0.59) TRPA1MAPTBACE1DAOPOLB
SCHEMBL50708 0.83 CNR1 (0.59) MAPTALOX5
SCHEMBL921274 0.82 CA1 (0.56) TRPA1MAPTMEN1KMT2ACA1
SCHEMBL51319 0.82 TRPA1 (0.64) TRPA1MAPTMEN1KMT2ACA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181853-B1 Thermosensitive recording medium JUJO PAPER CO LTD (JP) 2015-09-23 EP disclosed
US-8492308-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2013-07-23 US disclosed
US-8129307-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2012-03-06 US disclosed
US-20110269622-A1 THERMOSENSITIVE RECORDING MEDIUM NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2011-11-03 US disclosed
US-20110130281-A1 THERMOSENSITIVE RECORDING MEDIUM API CORPORATION 2011-06-02 US disclosed
EP-2112001-B1 THERMOSENSITIVE RECORDING MEDIUM JUJO PAPER CO LTD (JP) 2011-05-11 EP disclosed
EP-2261045-A1 HEAT-SENSITIVE RECORDING MEDIUM Nippon Paper Industries Co., Ltd. (JP) 2010-12-15 EP disclosed
EP-2181853-A1 THERMAL RECORDING MATERIAL Nippon Paper Industries Co., Ltd. (JP) 2010-05-05 EP disclosed
US-20100099557-A1 Thermosensitive Recording Medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2010-04-22 US disclosed
US-7141359-B2 Developers for thermal recording materials and thermal recording materials API CORPORATION (JP) 2006-11-28 US disclosed
US-20050118526-A1 Developers for thermal recording materials and thermal recording materials MITSUBISHI CHEMICAL CORPORATION (JP) 2005-06-02 US disclosed
EP-1393923-A1 DEVELOPERS FOR THERMAL RECORDING MATERIALS AND THERMAL RECORDING MATERIALS API Corporation (JP) 2004-03-03 EP disclosed
US-H732-H Polymer blend SHELL OIL COMPANY (US) 1990-02-06 US disclosed