SCHEMBL1629409

SCHEMBL1629409

CCCCO[Ti](O)(OCCCC)OCCCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.42
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
ALDH1A1 P00352 2/20 0.40
ATM Q13315 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37
CYP3A4 P08684 1/20 0.36
HPGD P15428 1/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
LMNA P02545 1/20 0.33
LTA4H P09960 1/20 0.32
NR5A1 Q13285 1/20 0.32
THRB P10828 2/20 0.32
MEN1 O00255 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 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
SCHEMBL2789915 0.82 TSHR (0.42) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL1886639 0.82
SCHEMBL260343 0.81 CA1 (0.33) CA1CA2
SCHEMBL20513493 0.81 ATM (0.34) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL20513982 0.81 ATM (0.34) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL9295821 0.80 TSHR (0.40) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL20513285 0.79 TSHR (0.32) TSHRADRB2ADRB1ADRB3ALDH1A1
Acetone SCHEMBL11442681 0.78 ALDH1A1 (0.48) TSHRALDH1A1ATMHCAR2CYP3A4
SCHEMBL7113609 0.77 ADRB2 (0.41) TSHRADRB2ADRB1ADRB3ALDH1A1
SCHEMBL35668 0.75 ADRB2 (0.45) TSHRADRB2ADRB1ADRB3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119875086-A Low refractive index polyester composition, preparation method and application thereof 东丽纤维研究所(中国)有限公司 2025-04-25 CN claimed
CN-118459737-A Polyester composition, and preparation method and application thereof 东丽纤维研究所(中国)有限公司 2024-08-09 CN claimed
CN-117923542-A Hollow TiO for PVDF film2Preparation method and application of nanospheres 广东电网有限责任公司 2024-04-26 CN claimed
CN-108610954-B Production method of insulating self-spraying paint for power equipment 阙燕娣 2020-11-03 CN claimed
US-4374968-A TRIETHYLENEDIAMINE OR ORGANOMETALLIC CATALYST HALLIBURTON COMPANY (US) 1983-02-22 US claimed
US-4365670-A TRIBUTYL TITANATE AS POLYMERIZATION CATALYSTS HALLIBURTON COMPANY (US) 1982-12-28 US claimed
US-4264486-A HAVING LONG GELATION TIME IN THE PRESENCE OF WATER HALLIBURTON COMPANY (US) 1981-04-28 US claimed
CN-119875086-A Low refractive index polyester composition, preparation method and application thereof 东丽纤维研究所(中国)有限公司 2025-04-25 CN disclosed
CN-118684869-A Polyester composition, and preparation method and application thereof 东丽纤维研究所(中国)有限公司 2024-09-24 CN disclosed
CN-118459737-A Polyester composition, and preparation method and application thereof 东丽纤维研究所(中国)有限公司 2024-08-09 CN disclosed
EP-4212575-B1 METHODS FOR MAKING POLYFUNCTIONAL ORGANOSILOXANES AND COMPOSITIONS CONTAINING SAME DOW SILICONES CORP (US) 2024-05-29 EP disclosed
EP-4363466-A1 PROCESSING-OPTIMIZED, REACTIVE POLYMER COMPOSITION Clariant International Ltd (CH) 2024-05-08 EP disclosed
CN-117923542-A Hollow TiO for PVDF film2Preparation method and application of nanospheres 广东电网有限责任公司 2024-04-26 CN disclosed
US-4374968-A TRIETHYLENEDIAMINE OR ORGANOMETALLIC CATALYST HALLIBURTON COMPANY (US) 1983-02-22 US disclosed
US-4365670-A TRIBUTYL TITANATE AS POLYMERIZATION CATALYSTS HALLIBURTON COMPANY (US) 1982-12-28 US disclosed
US-4365670-A TRIBUTYL TITANATE AS POLYMERIZATION CATALYSTS HALLIBURTON COMPANY (US) 1982-12-28 US disclosed
EP-0065777-A1 Flame-retardant resin composition TEIJIN LIMITED (JP) 1982-12-01 EP disclosed
EP-0057415-A2 Polyester resin composition TEIJIN LIMITED (JP) 1982-08-11 EP disclosed
US-4264486-A HAVING LONG GELATION TIME IN THE PRESENCE OF WATER HALLIBURTON COMPANY (US) 1981-04-28 US disclosed
US-4223126-A Linear copolyesters containing tertiary butyl isophthalic acid THE GOODYEAR TIRE & RUBBER COMPANY (US) 1980-09-16 US disclosed