SCHEMBL459693

SCHEMBL459693

Oc1ccc2c(c1)CCCO2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 7/20 0.49
WNT3A P56704 7/20 0.49
PRKCI P41743 2/20 0.49
CLK1 P49759 1/20 0.46
DYRK1A Q13627 1/20 0.46
DYRK1B Q9Y463 1/20 0.46
CYP3A4 P08684 1/20 0.45
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
MAOA P21397 2/20 0.44
MAOB P27338 2/20 0.44
NOTUM Q6P988 1/20 0.44
ERN1 O75460 1/20 0.41
RIPK1 Q13546 1/20 0.40
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL29674920 1.00 CTNNB1 (0.49) CTNNB1WNT3APRKCICLK1DYRK1A
SCHEMBL28874219 0.98 CTNNB1 (0.48) CTNNB1WNT3APRKCICLK1DYRK1A
Trimethylammonium SCHEMBL27715779 0.93 CTNNB1 (0.44) CTNNB1WNT3APRKCICLK1DYRK1A
SCHEMBL281830 0.88 PRKCI (0.56) PRKCIDYRK1ADYRK1BCYP3A4ESR1
SCHEMBL27578676 0.85 ERN1 (0.50) CTNNB1WNT3APRKCICLK1DYRK1A
SCHEMBL29598243 0.84 MAOA (0.49) CTNNB1WNT3APRKCICYP3A4ESR1
Ethane SCHEMBL28204754 0.84 PRKCI (0.53) PRKCIDYRK1ADYRK1BCYP3A4ESR1
SCHEMBL8699804 0.84 MAOA (0.49) CTNNB1WNT3APRKCICYP3A4ESR1
Hydrochloric Acid SCHEMBL28232988 0.82 MAOA (0.47) CTNNB1WNT3ACYP3A4ESR1ESR2
SCHEMBL10549128 0.80 CLK1 (0.46) CTNNB1WNT3APRKCICLK1DYRK1A

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 1657 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3672593-B1 MEDICAMENTS FOR THE TREATMENT OF VASOCONSTRICTION RELATED DISEASES OR DISORDERS SULFATEQ BV (NL) 2024-12-18 EP claimed
US-12156862-B2 Medicaments for the treatment of vasoconstriction related diseases or disorders SULFATEQ B.V. (NL) 2024-12-03 US claimed
US-20240043794-A1 Chemically Defined Serum Albumin Substitutes Life Technologies Corporation 2024-02-08 US claimed
CN-111479873-B Thermoplastic vulcanizates and compositions thereof 国际人造丝公司 2023-11-10 CN claimed
EP-4263803-A1 CHEMICALLY DEFINED SERUM ALBUMIN SUBSTITUTES Life Technologies Corporation (US) 2023-10-25 EP claimed
US-11773244-B2 Thermoplastic vulcanizates and compositions thereof CELANESE INTERNATIONAL CORPORATION (US) 2023-10-03 US claimed
CN-116802271-A Chemically defined serum albumin substitutes 生命技术公司 2023-09-22 CN claimed
US-11730741-B2 6-chromanol derivatives for use as a medicament SULFATEQ B.V. (NL) 2023-08-22 US claimed
EP-3707205-B1 THERMOPLASTIC VULCANIZATES AND COMPOSITIONS THEREOF EXXONMOBIL CHEMICAL PATENTS INC (US) 2023-07-05 EP claimed
CN-114184727-B Identification method of three medicinal materials from gleditsia sinensis and application thereof 天津中医药大学 2023-04-25 CN claimed
US-5100930-A Polyolefin, Phenolic Antioxidant, Slip Agent and/or Antistatic Agent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-03-31 US claimed
EP-0445735-A1 Melanogenesis-inhibiting endermic preparation Sansho Seiyaku Co., Ltd. (JP) 1991-09-11 EP claimed
US-5043460-A Discoloration inhibition; color photography FUJI PHOTO FILM CO., LTD. (JP) 1991-08-27 US claimed
EP-0407198-A1 Food container SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-01-09 EP claimed
EP-0180190-B1 3,4-DIHYDROBENZOPYRAN COMPOUNDS AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME KURARAY CO., LTD. (JP) 1990-03-14 EP claimed
US-4906559-A Light-sensitive silver halide photographic material KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1990-03-06 US claimed
US-4243747-A MAGENTA COUPLER, 2,5-BIS/1*,1*-DIMETHYLBUTYL/HYDROQUINONE FUJI PHOTO FILM CO., LTD. (JP) 1981-01-06 US claimed
US-4138259-A Color photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1979-02-06 US claimed
US-4113488-A PHENOLIC COMPOUND AND SYNERGISTIC SULFIDE OR SULFOXIDE FUJI PHOTO FILM CO., LTD. (JP) 1978-09-12 US claimed
US-3951660-A HETEROCYCLIC TONER COMPOUND AGFA-GEVAERT, A.G. (DT) 1976-04-20 US claimed