SCHEMBL316145

SCHEMBL316145

O=C(O)C1(C(=O)O)C=CC(c2ccccc2)C=C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 1/20 0.35
HDAC4 P56524 4/20 0.34
HDAC3 O15379 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP2C19 P33261 1/20 0.34
CA2 P00918 1/20 0.33
EPHX1 P07099 1/20 0.33
OPRK1 P41145 1/20 0.33
AKR1C1 Q04828 2/20 0.32
AKR1C3 P42330 1/20 0.32
POLB P06746 1/20 0.32
THRB P10828 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP3A4 P08684 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL6808142 0.89 POLB (0.36) EDNRAHDAC4HDAC3HDAC7HDAC8
SCHEMBL21173936 0.87 POLB (0.32) EDNRAHDAC4HDAC3HDAC7HDAC8
SCHEMBL5479510 0.84 POLB (0.38) EDNRAHDAC4HDAC3HDAC7HDAC8
SCHEMBL4608630 0.84 AKR1C3 (0.34) EDNRAHDAC4HDAC3HDAC7HDAC8
SCHEMBL6275799 0.84 SLC9A1 (0.36) EDNRAHDAC4HDAC3HDAC7HDAC8
SCHEMBL1119643 0.82 THRB (0.35) EDNRAHDAC4HDAC3HDAC7HDAC8
SCHEMBL3583056 0.80 GRM1 (0.35) EDNRAHDAC4HDAC3HDAC7HDAC8
SCHEMBL2121106 0.80 KDM1A (0.34) EDNRAHDAC4HDAC3HDAC7HDAC8
SCHEMBL2508140 0.80 HTR2A (0.35) EDNRAHDAC4HDAC3HDAC7HDAC8
SCHEMBL4371618 0.80 SLC9A1 (0.36) EDNRAMAPK1CYP2C19OPRK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116144335-B Two-dimensional nanoemulsifier and preparation method and application thereof 中国石油天然气股份有限公司 2024-07-02 CN claimed
CN-116601205-A Polyester resin composition 可隆塑胶株式会社 2023-08-15 CN claimed
CN-116144335-A Two-dimensional nanoemulsifier and preparation method and application thereof 中国石油天然气股份有限公司 2023-05-23 CN claimed
CN-116083066-A Composite flooding composition of two-dimensional nano particles and preparation method of two-dimensional nano particles 中国石油天然气股份有限公司 2023-05-09 CN claimed
CN-114349143-B Complex coacervate phase system and preparation method and application thereof 扬州大学 2023-04-14 CN claimed
CN-110121537-B Coating composition capable of achieving low curling and film prepared therefrom 株式会社东进世美肯 2022-12-23 CN claimed
CN-115216498-A Method for reinforced synthesis of bio-based 1, 5-pentanediamine by using MOF (Metal organic framework) immobilized lysine decarboxylase 中国科学院过程工程研究所 2022-10-21 CN claimed
CN-112850685-B Two-dimensional carbon material and preparation method and application thereof 厦门稀土材料研究所 2022-10-18 CN claimed
CN-109790292-B Process for preparing polybenzazole polymer (P) 巴斯夫欧洲公司 2022-05-31 CN claimed
CN-114349143-A Complex coacervate phase system and preparation method and application thereof 扬州大学 2022-04-15 CN claimed
US-6074758-A Poly(hydroxy ester ethers) as barrier resins EASTMAN CHEMICAL COMPANY (US) 2000-06-13 US claimed
CN-1236358-A Substituted N-[(aminoiminomethyl or aminomethyl) phenyl] propyl amides RHONE POULENC RORER PHARMA (US) 1999-11-24 CN claimed
US-5919403-A POLYESTERS EASTMAN CHEMICAL COMPANY (US) 1999-07-06 US claimed
CN-1214712-A Polyester/polyesteramide blends EASTMAN CHEM CO (US) 1999-04-21 CN claimed
CN-1205728-A Polyester/polyamide blend having improved flavor retaining property and clarity EASTMAN CHEM CO (US) 1999-01-20 CN claimed
US-5624987-A Polyalkylene ethers as plasticizers and flow aids in poly(1,4-cyclohexanedimethylene terephthalate) resins TICONA LLC 1997-04-29 US claimed
EP-0076073-B2 Granular moulding compositions SCOTT BADER COMPANY LIMITED (GB) 1990-06-13 EP claimed
EP-0076073-B1 GRANULAR MOULDING COMPOSITIONS SCOTT BADER COMPANY LIMITED (GB) 1986-02-26 EP claimed
US-4439559-A UNSATURATED POLYESTER, MONOMER, FILLER, REINFORCEMENT SCOTT BADER COMPANY LIMITED (GB) 1984-03-27 US claimed
EP-0076073-A1 Granular moulding compositions SCOTT BADER COMPANY LIMITED (GB) 1983-04-06 EP claimed