SCHEMBL3191876

SCHEMBL3191876

CCC(C)c1cc(C(C)(C)C)cc(-n2nc3ccc(C(C)(C)C)cc3n2)c1O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.44
TSHR P16473 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SCN10A Q9Y5Y9 7/20 0.32
POLB P06746 1/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL713026 0.93 RORC (0.40) RORCTSHRCYP1A2CYP3A4CYP2C9
SCHEMBL708739 0.93 RORC (0.40) RORCTSHRCYP1A2CYP3A4CYP2C9
SCHEMBL710416 0.92 RORC (0.40) RORCTSHRCYP1A2CYP3A4CYP2C9
SCHEMBL29706550 0.92 RORC (0.40) RORCTSHRCYP1A2CYP3A4CYP2C9
SCHEMBL29463599 0.90 NPC1 (0.45) RORCTSHRCYP1A2CYP3A4CYP2C9
SCHEMBL78803 0.90 NPC1 (0.45) RORCTSHRCYP1A2CYP3A4CYP2C9
SCHEMBL5447098 0.90 RORC (0.39) RORCTSHRCYP1A2CYP3A4CYP2C9
SCHEMBL7537640 0.88 RORC (0.37) RORCTSHRCYP1A2CYP3A4CYP2C9
SCHEMBL11416372 0.88 RORC (0.37) RORCTSHRCYP1A2CYP3A4CYP2C9
SCHEMBL6454940 0.86 RORC (0.36) RORCTSHRCYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0039367-A4 UV-ABSORBING COMPOUNDS AND PHOTOGRAPHIC ELEMENTS CONTAINING THEM. MINNESOTA MINING & MFG (US) 1982-07-12 EP claimed
US-4323633-A BUTYLATED 2-HYDROXYPHENYL BENZOTRIAZOLE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1982-04-06 US claimed
EP-0039367-A1 UV-ABSORBING COMPOUNDS AND PHOTOGRAPHIC ELEMENTS CONTAINING THEM MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1981-11-11 EP claimed
WO-1981001473-A1 UV-ABSORBING COMPOUNDS AND PHOTOGRAPHIC ELEMENTS CONTAINING THEM MINNESOTA MINING & MFG (US) 1981-05-28 WO claimed
EP-3031611-B1 THERMAL RECORDING MATERIAL MITSUBISHI PAPER MILLS LTD (JP) 2017-09-27 EP disclosed
EP-3031611-A1 THERMAL RECORDING MATERIAL Mitsubishi Paper Mills Limited (JP) 2016-06-15 EP disclosed
EP-2096149-B1 INK FOR SCRATCH COLORING AND SHEET WITH INVISIBLE INFORMATION PRINTED MITSUBISHI PAPER MILLS LTD (JP) 2014-10-22 EP disclosed
US-8283285-B2 Scratch color-developable ink and invisible information printed sheet MITSUBISHI PAPER MILLS LIMITED (JP) 2012-10-09 US disclosed
US-20100021702-A1 SCRATCH COLOR-DEVELOPABLE INK AND INVISIBLE INFORMATION PRINTED SHEET MITSUBISHI PAPER INK MFG. CO., LTD. (JP) 2010-01-28 US disclosed
EP-2096149-A1 INK FOR SCRATCH COLORING AND SHEET WITH INVISIBLE INFORMATION PRINTED Mitsubishi Paper Mills Limited (JP) 2009-09-02 EP disclosed
US-6921740-B1 Electron-receiving compound and thermal recording material MITSUBISHI PAPER MIILS LTD. (JP) 2005-07-26 US disclosed
US-6890881-B2 Thermal recording materials MITSUBISHI PAPER MILLS LTD. (JP) 2005-05-10 US disclosed
US-20040029056-A1 Thermal recording materials MITSUBISHI PAPER MILLS LTD. (JP) 2004-02-12 US disclosed
EP-0767074-B1 A thermal recording medium JUJO PAPER CO LTD (JP) 2001-04-11 EP disclosed
US-5731262-A ULTRAVIOLET ABSORBER, SCREENER CONSISTING OF CALCINED PIGMENT PARTICLES COATED WITH INSOLUBLE CERIUM COMPOUND, AND FLUORESCENT DYE; LIGHT RESISTANCE NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1998-03-24 US disclosed
EP-0767074-A2 A thermal recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1997-04-09 EP disclosed
EP-0039367-A4 UV-ABSORBING COMPOUNDS AND PHOTOGRAPHIC ELEMENTS CONTAINING THEM. MINNESOTA MINING & MFG (US) 1982-07-12 EP disclosed
US-4323633-A BUTYLATED 2-HYDROXYPHENYL BENZOTRIAZOLE MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1982-04-06 US disclosed
EP-0039367-A1 UV-ABSORBING COMPOUNDS AND PHOTOGRAPHIC ELEMENTS CONTAINING THEM MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1981-11-11 EP disclosed
WO-1981001473-A1 UV-ABSORBING COMPOUNDS AND PHOTOGRAPHIC ELEMENTS CONTAINING THEM MINNESOTA MINING & MFG (US) 1981-05-28 WO disclosed