SCHEMBL916579

SCHEMBL916579

CCCOC(CC(C(C)=O)C(=O)[O-])(OCCC)OCCC.CCCOC(CC(C(C)=O)C(=O)[O-])(OCCC)OCCC.CCCOC(CC(C(C)=O)C(=O)[O-])(OCCC)OCCC.CCCOC(CC(C(C)=O)C(=O)[O-])(OCCC)OCCC.[Ti+4]

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.31
TSHR P16473 2/20 0.31
NFKB1 P19838 2/20 0.31
NPSR1 Q6W5P4 2/20 0.31
CA2 P00918 2/20 0.31

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
SCHEMBL109541 0.90 ALDH1A1 (0.36) CA2
SCHEMBL106375 0.87 ALDH1A1 (0.36) CA2
SCHEMBL2479263 0.84 LMNA (0.32)
SCHEMBL7641876 0.75
SCHEMBL992975 0.74 ALDH1A1 (0.39) TSHRCA2
SCHEMBL2531290 0.72 ALDH1A1 (0.38) TSHRCA2
SCHEMBL2384267 0.70 CYP3A4 (0.32) CYP3A4TSHRNFKB1NPSR1
SCHEMBL1230558 0.70 CA2 (0.36) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL8152736 0.69 NFKB1 (0.52) CYP3A4TSHRNFKB1NPSR1CA2
SCHEMBL230829 0.68 TSHR (0.39) CYP3A4TSHRNFKB1NPSR1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3733756-B1 TREAD RUBBER COMPOSITION FOR STUDLESS WINTER TIRES SUMITOMO RUBBER IND (JP) 2026-01-28 EP disclosed
US-12415907-B2 Rubber composition and run-flat tire BRIDGESTONE CORPORATION (JP) 2025-09-16 US disclosed
EP-3640291-B1 VULCANIZED RUBBER, TIRE, AND RUN-FLAT TIRE BRIDGESTONE CORP (JP) 2025-02-26 EP disclosed
EP-3725839-B1 RUBBER COMPOSITION AND TIRE USING SAME BRIDGESTONE CORP (JP) 2024-10-30 EP disclosed
US-12018152-B2 Polybutadiene composition and method for producing same ENEOS MATERIALS CORPORATION (JP) 2024-06-25 US disclosed
EP-3677438-B1 PNEUMATIC TIRE BRIDGESTONE CORP (JP) 2023-11-15 EP disclosed
EP-3896100-B1 POLYBUTADIENE COMPOSITION AND METHOD FOR PRODUCING SAME ENEOS MAT CORPORATION (JP) 2023-06-21 EP disclosed
US-11613144-B2 Pneumatic tire BRIDGESTONE CORPORATION (JP) 2023-03-28 US disclosed
US-20220363093-A1 RUN-FLAT TIRE BRIDGESTONE CORPORATION (JP) 2022-11-17 US disclosed
US-20220348746-A1 RUBBER COMPOSITION AND RUN-FLAT TIRE BRIDGESTONE CORPORATION (JP) 2022-11-03 US disclosed
US-7893153-B2 Process for producing modified conjugated diene polymer, modified conjugated diene polymer obtained by the process, and rubber composition containing the same JSR CORPORATION (JP) 2011-02-22 US disclosed
US-20110015302-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER, AND RUBBER COMPOSITION JSR CORPORATION (JP) 2011-01-20 US disclosed
EP-2258765-A1 RUBBER COMPOSITION FOR TIRE BASE RUBBER COMPOSITION, AND PNEUMATIC TIRE MADE USING SAID RUBBER COMPOSITION Bridgestone Corporation (JP) 2010-12-08 EP disclosed
EP-2253664-A1 RUBBER COMPOSITION AND TIRES USING THE SAME, AS WELL AS MODIFIED CONJUGATE DIENE POLYMER AND MANUFACTURING METHOD THEREOF Bridgestone Corporation (JP) 2010-11-24 EP disclosed
US-20100222502-A1 PROCESS FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER OBTAINED BY THE PROCESS, AND RUBBER COMPOSITION CONTAINING THE SAME JSR CORPORATION (JP) 2010-09-02 US disclosed
US-20100113683-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE BASED (CO)POLYMER, MODIFIED CONJUGATED DIENE BASED (CO)POLYMER, AND RUBBER COMPOSITION JSR CORPORATION (JP) 2010-05-06 US disclosed
US-20100105827-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER, AND RUBBER COMPOSITION JSR CORPORATION (JP) 2010-04-29 US disclosed
EP-2130841-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER, AND RUBBER COMPOSITION JSR Corporation (JP) 2009-12-09 EP disclosed
EP-2098540-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER, AND RUBBER COMPOSITION JSR Corporation (JP) 2009-09-09 EP disclosed
EP-2098554-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE POLYMER, MODIFIED CONJUGATED DIENE POLYMER, AND RUBBER COMPOSITION JSR Corporation (JP) 2009-09-09 EP disclosed