SCHEMBL331362

SCHEMBL331362

c1cc2c(c3c1OCCS3)OCCS2

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 4/20 0.37
WNT3A P56704 4/20 0.37
MTNR1A P48039 4/20 0.34
MTNR1B P49286 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
SCHEMBL330723 0.85 CTNNB1 (0.37) CTNNB1WNT3AMTNR1A
SCHEMBL331077 0.85 CTNNB1 (0.37) CTNNB1WNT3AMTNR1A
SCHEMBL10335517 0.69
SCHEMBL29395580 0.69 ITGB2 (0.52) CTNNB1WNT3AMTNR1A
SCHEMBL255962 0.69 ITGB2 (0.52) CTNNB1WNT3AMTNR1A
SCHEMBL14188443 0.67 MTNR1A (0.38) CTNNB1WNT3AMTNR1AMTNR1B
SCHEMBL14188455 0.67 MAPK1 (0.32) CTNNB1WNT3A
SCHEMBL19492343 0.67 MAPT (0.42) CTNNB1WNT3A
SCHEMBL5746800 0.67 CYP3A4 (0.45) CTNNB1WNT3A
SCHEMBL24214639 0.65 NOTUM (0.37) CTNNB1WNT3A

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 130 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4775733-A POLYTHIOURETHANES MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1988-10-04 US claimed
US-6391433-B1 None US disclosed
US-11807755-B2 Polymerizable composition for optical material, molded product, optical material, plastic lens, and laminated plastic lens MITSUI CHEMICALS, INC. (JP) 2023-11-07 US disclosed
EP-3444236-B1 XYLYLENEDIISOCYANATE COMPOSITION, RESIN, AND POLYMERIZABLE COMPOSITION MITSUI CHEMICALS INC (JP) 2020-12-30 EP disclosed
US-20200308400-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, MOLDED PRODUCT, OPTICAL MATERIAL, PLASTIC LENS, AND LAMINATED PLASTIC LENS MITSUI CHEMICALS, INC. (JP) 2020-10-01 US disclosed
EP-2497791-B1 METHOD FOR PRODUCING INTERNAL MOLD RELEASE AGENT FOR OPTICAL MATERIAL, INTERNAL MOLD RELEASE AGENT FOR OPTICAL MATERIAL, AND POLYMERIZABLE COMPOSITION INCLUDING THE SAME MITSUI CHEMICALS INC (JP) 2020-05-13 EP disclosed
EP-3168256-B1 EYEWEAR MATERIAL COMPRISING A POLYURETHANE RESIN, EYEWEAR FRAME AND LENS MITSUI CHEMICALS INC (JP) 2019-08-07 EP disclosed
US-20190106529-A1 XYLYLENE DIISOCYANATE COMPOSITION, RESIN, AND POLYMERIZABLE COMPOSITION MITSUI CHEMICALS, INC. (JP) 2019-04-11 US disclosed
EP-3037411-B1 1,4-BIS(ISOCYANATOMETHYL)CYCLOHEXANE, POLYISOCYANATE COMPOSITION, POLYURETHANE RESIN, MOLDED ARTICLE, EYEWEAR MATERIAL, EYEWEAR FRAME AND LENS MITSUI CHEMICALS INC (JP) 2019-03-27 EP disclosed
US-10227468-B2 Polyurethane resin MITSUI CHEMICALS, INC. (JP) 2019-03-12 US disclosed
US-5059673-A bis(isocyanatomethyl)-norbornane or -4,7methonohexahydroindan e high refractive index, lightweight, high impact MITSUI TOATSU CHEMICALS, INC. (JP) 1991-10-22 US disclosed
US-5021503-A Polythiourethanes from sulfur-containing aliphatic diisocyanates and polythiols or polyols; colorless MITSUI TOATSU CHEMICALS, INC. (JP) 1991-06-04 US disclosed
US-5013496-A Polyurethane or polythiourethane MITSUI TOATSU CHEMICALS, INC. (JP) 1991-05-07 US disclosed
EP-0422836-A2 Resin for urethane lenses, lenses comprising the resin, and a process for preparation of the resin and the lenses MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-04-17 EP disclosed
EP-0374258-A1 HIGH REFRACTIVE INDEX LENS AND METHOD FOR ITS PRODUCTION MITSUI CHEMICALS, INC. (JP) 1990-06-27 EP disclosed
EP-0235743-B1 HIGH-REFRACTIVITY PLASTIC LENS RESIN MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-01-31 EP disclosed
EP-0351073-A2 Lens comprising a resin having a large refractive index and process for preparing the lens MITSUI TOATSU CHEMICALS, Inc. (JP) 1990-01-17 EP disclosed
EP-0330363-A2 Highly-refractive plastic lens and process for making the lens MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-08-30 EP disclosed
US-4775733-A POLYTHIOURETHANES MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1988-10-04 US disclosed
EP-0235743-A1 High-refractivity plastic lens resin MITSUI TOATSU CHEMICALS, Inc. (JP) 1987-09-09 EP disclosed