SCHEMBL711973

SCHEMBL711973

[c]1cccc(Cc2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.57
LTA4H P09960 2/20 0.40
KDM4E B2RXH2 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
IDH1 O75874 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
PLA2G10 O15496 1/20 0.38
PLA2G2A P14555 1/20 0.38
LMNA P02545 1/20 0.38
BCL2 P10415 1/20 0.37
BCL2L1 Q07817 1/20 0.37
SLC22A2 O15244 1/20 0.36
TSHR P16473 2/20 0.35
IDO1 P14902 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL2585956 0.93 CALM1 (0.43) CALM1LTA4HKDM4ECYP3A4MAPT
SCHEMBL27430888 0.83 TP53 (0.44) CALM1LTA4HMAPTCA2LMNA
SCHEMBL2874671 0.83 LMNA (0.37) CALM1LMNAIDO1LOXL2ALDH1A1
SCHEMBL9686662 0.83 SRD5A2 (0.38) CALM1LTA4HMAPTLMNAIDO1
SCHEMBL8900207 0.83 SIGMAR1 (0.37) CALM1CYP3A4MAPTLMNAIDO1
SCHEMBL27739505 0.83 CALM1 (0.37) CALM1LTA4HCYP3A4IDH1CA12
SCHEMBL27754324 0.83 ALDH1A1 (0.44) CALM1LTA4HCYP3A4IDH1CA12
SCHEMBL7911223 0.83 ESR1 (0.56) CALM1KDM4EIDH1CA2LMNA
SCHEMBL1451843 0.83 CYP11B1 (0.41) CALM1LTA4HCYP3A4MAPTLOXL2
SCHEMBL27426676 0.82 MAOB (0.51) LTA4HMAPTCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023217539-A1 ANTIVIRAL COMPOUNDS AND COMPOSITIONS THEREFROM CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (ES) 2023-11-16 WO claimed
EP-4276093-A1 ANTIVIRAL COMPOUNDS AND COMPOSITIONS THEREFROM Consejo Superior De Investigaciones Científicas (ES) 2023-11-15 EP claimed
EP-3373991-B1 HIGH-IMPACT, TRANSPARENT PROSTHESIS MATERIAL HAVING A LOW RESIDUAL MMA CONTENT KULZER & CO GMBH (DE) 2020-07-01 EP claimed
CN-110072907-A Epoxy-stabilized is realized using substituted barbiturates 3M创新有限公司 2019-07-30 CN claimed
CN-105310888-B Dental regulation composition 株式会社松风 2019-05-21 CN claimed
CN-108472411-A High impact toughness transparent prosthetic materials with low residual MMA content 古莎有限公司 2018-08-31 CN claimed
CN-108348403-A Redox polymerizable compositions containing photolabile transition metal complexes 3M创新有限公司 2018-07-31 CN claimed
CN-106661384-A A multi-part acrylic cold-curing composition 璐彩特国际特殊高分子聚合树脂有限公司 2017-05-10 CN claimed
CN-106535949-A Auto-polymerizable prosthetic material and polymerized, fracture-tough prosthetic material with increased colour stability 贺利氏古萨有限公司 2017-03-22 CN claimed
EP-2632420-B1 GLUTAMINE DERIVATIVES AS DEODORANTS GIVAUDAN SA (CH) 2017-01-04 EP claimed
US-5196610-A INSECTICIDAL ETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-03-23 US claimed
CN-1019191-B INSECTICIDAL ETHERS ICI PLC (GB) 1992-11-25 CN claimed
CN-1019109-B The insect-killing composition that contains diphenyl ether derivatives pesticide compound ICI PLC (GB) 1992-11-18 CN claimed
EP-0211561-B1 INSECTICIDAL ETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-03-11 EP claimed
EP-0240121-B1 DIPHENYL ETHER DERIVATIVES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-04-17 EP claimed
EP-0390228-A2 Chemical intermediates IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-10-03 EP claimed
US-4883789-A Substituted phenyltrialkylsilane insecticides FMC CORPORATION (US) 1989-11-28 US claimed
US-4791139-A Diphenyl ether derivatives and their use as insecticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-12-13 US claimed
EP-0240121-A2 Diphenyl ether derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-10-07 EP claimed
EP-0211561-A1 Insecticidal ethers IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-02-25 EP claimed