SCHEMBL128131

SCHEMBL128131

CC(C)(C)CC(C)(OOC(C)(C)c1ccccc1)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.65
ALDH1A1 P00352 3/20 0.45
ALOX15 P16050 1/20 0.45
TAAR1 Q96RJ0 2/20 0.36
HIF1A Q16665 2/20 0.33
CYP2C19 P33261 1/20 0.33
POLB P06746 1/20 0.33
SLC6A2 P23975 2/20 0.32
ESR1 P03372 3/20 0.31
ESR2 Q92731 2/20 0.31
CYP3A4 P08684 2/20 0.31
KCNN4 O15554 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
MAPT P10636 2/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
APAF1 O14727 1/20 0.31
MLNR O43193 1/20 0.31
NR1I2 O75469 1/20 0.31
USP2 O75604 1/20 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
SCHEMBL22351 0.92 MAPK1 (0.50) MAPK1ALDH1A1ALOX15TAAR1HIF1A
SCHEMBL7606018 0.87 MAPK1 (0.59) MAPK1ALDH1A1ALOX15TAAR1HIF1A
SCHEMBL7628903 0.86 MAPK1 (0.45) MAPK1ALDH1A1ALOX15TAAR1HIF1A
SCHEMBL30251835 0.82 MAPK1 (0.68) MAPK1ALDH1A1ALOX15TAAR1HIF1A
SCHEMBL14389655 0.82 MAPK1 (0.68) MAPK1ALDH1A1ALOX15TAAR1HIF1A
SCHEMBL5533568 0.81 MAPK1 (0.55) MAPK1ALDH1A1ALOX15TAAR1CYP2C19
Benzene SCHEMBL25312146 0.81 MAPK1 (1.00) MAPK1ALDH1A1ALOX15TAAR1HIF1A
SCHEMBL8939342 0.81 MAPK1 (1.00) MAPK1ALDH1A1ALOX15TAAR1HIF1A
SCHEMBL15450 0.81 MAPK1 (1.00) MAPK1ALDH1A1ALOX15TAAR1HIF1A
SCHEMBL27506519 0.81 MAPK1 (1.00) MAPK1ALDH1A1ALOX15TAAR1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114085519-B Polyamide composition and preparation method and application thereof 上海金发科技发展有限公司 2023-12-19 CN claimed
WO-2024142767-A1 RUBBER COMPOSITION FOR SEAL MATERIAL 株式会社バルカー 2024-07-04 WO disclosed
WO-2024135527-A1 SEALING MATERIAL COMPOSITION FOR HIGH PRESSURE HYDROGEN GAS 株式会社バルカー 2024-06-27 WO disclosed
US-20240166918-A1 Bonded Object, and Method for Manufacturing Bonded Object VALQUA, LTD. (JP) 2024-05-23 US disclosed
WO-2024095852-A1 PELLET SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 2024-05-10 WO disclosed
WO-2024095408-A1 PELLET SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 2024-05-10 WO disclosed
US-20230365848-A1 Sealing Material and Method for Producing Sealing Material VALQUA, LTD. (JP) 2023-11-16 US disclosed
US-20230365799-A1 Elastomer Composition, Sealing Material, and Method for Producing Sealing Material VALQUA, LTD. (JP) 2023-11-16 US disclosed
US-20230365802-A1 Elastomer Composition, Sealing Material, and Method for Producing Sealing Material VALQUA, LTD. (JP) 2023-11-16 US disclosed
US-20230365800-A1 Elastomer Composition, Sealing Material, and Method for Producing Sealing Material VALQUA, LTD. (JP) 2023-11-16 US disclosed
EP-1263795-B1 METHOD FOR PRODUCING POLYMERS BASF AG (DE) 2004-09-15 EP disclosed
US-6300416-B1 USEFUL AS TIRE SIDEWALL OR TIRE TREAD; STRENGTH PROPERTIES AND BENDING FATIGUE RESISTANCE AND LOW FUEL CONSUMPTION MITSUI CHEMICALS, INC. (JP) 2001-10-09 US disclosed
CN-1217685-A VULCANIZED MOLDING HAVING SURFACE DECORATIVE LAYER, PAINTED THERMOPLASTIC RESIN COMPOSITION AND PAINTED ELASTOMER COMPOSITION MITSUI CHEMICALS INC (JP) 1999-05-26 CN disclosed
CN-1216055-A RUBBER COMPOSITIONS FOR TIRES MITSUI CHEMICALS INC (JP) 1999-05-05 CN disclosed
EP-0893245-A1 VULCANIZED MOLDING HAVING SURFACE DECORATIVE LAYER, PAINTED THERMOPLASTIC RESIN COMPOSITION, AND PAINTED ELASTOMER COMPOSITION Mitsui Chemicals, Inc. (JP) 1999-01-27 EP disclosed
EP-0889091-A1 RUBBER COMPOSITIONS FOR TIRES Mitsui Chemicals, Inc. (JP) 1999-01-07 EP disclosed
EP-0171626-B1 ADHESIVE RESINS AND LAMINATE ARTICLES NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-10-03 EP disclosed
US-4737548-A UNSATURATED FATTY-ACID REACTED POLYMERS OF ETHYLENE, UNSATURATED GLYCIDYL-CONTAINING MONOMER AND AN UNSATURATED MONOMER; BONDING STRENGTH; FOOD WRAPPING NIPPON PETROCHEMICALS (JP) 1988-04-12 US disclosed
US-4654255-A BLEND OF OLEFIN POLYMER WITH ADHESIVE RESIN OF EPOXY-OLEFIN POLYMER AND UNSATURATED FATTY ACID NIPPON PETROCHEMICALS (JP) 1987-03-31 US disclosed
EP-0171626-A2 Adhesive resins and laminate articles NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1986-02-19 EP disclosed