SCHEMBL4335863

SCHEMBL4335863

CCOc1ccc([C]2CC2(Cl)Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NQO1 P15559 1/20 0.54
▸ TSHR P16473 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ RAB9A P51151 6/20 0.43
▸ KDM4E B2RXH2 6/20 0.43
▸ NPC1 O15118 5/20 0.43
▸ SMN1; SMN2 Q16637 5/20 0.43
▸ MAPT P10636 2/20 0.43
▸ LTA4H P09960 2/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ TP53 P04637 3/20 0.41
▸ HPGD P15428 3/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ SENP8 Q96LD8 1/20 0.41
▸ NLRP3 Q96P20 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ SENP6 Q9GZR1 1/20 0.41
▸ HSD17B10 Q99714 4/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40

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
SCHEMBL7727518 0.85 LTA4H (0.44) TSHRRAB9AKDM4ENPC1SMN1; SMN2
SCHEMBL20593408 0.81 NQO1 (0.54) NQO1TSHRTDP1RAB9AKDM4E
SCHEMBL5319002 0.77 NQO1 (0.48) NQO1TSHRTDP1RAB9AKDM4E
SCHEMBL18417193 0.76 NQO1 (0.82) NQO1TSHRTDP1RAB9AKDM4E
SCHEMBL9155582 0.76 NQO1 (0.82) NQO1TSHRTDP1RAB9AKDM4E
SCHEMBL5833291 0.76 NQO1 (0.82) NQO1TSHRTDP1RAB9AKDM4E
1,4-Diethoxybenzene SCHEMBL124015 0.73 NQO1 (1.00) NQO1TSHRTDP1KDM4ENPC1
1,4-Diethoxybenzene SCHEMBL28186701 0.73 NQO1 (1.00) NQO1TSHRTDP1KDM4ENPC1
SCHEMBL5315410 0.73 SLC6A2 (0.38) TSHRMAPTMEN1KMT2ACYP1A2
SCHEMBL9586178 0.71 NQO1 (0.64) NQO1TSHRTDP1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0049977-B1 INSECTICIDAL (1,1'-BIPHENYL)-3-YLMETHYL ESTERS, THEIR PRODUCTION AND USE AND COMPOSITIONS CONTAINING THEM FMC Corporation (US) 1986-02-26 — — EP claimed
US-4536591-A Insecticidal [1,1'-biphenyl]-3-ylmethyl esters FMC CORPORATION (US) 1985-08-20 — — US claimed
EP-0143152-A2 Insecticidal (1,1'-biphenyl)-3-ylmethyl esters, their production and use and compositions containing them FMC Corporation (US) 1985-06-05 — — EP claimed
US-4493844-A Insecticidal 2,2'-bridged(1,1'-biphenyl)-3-ylmethyl carboxamides FMC CORPORATION (US) 1985-01-15 — — US claimed
US-4487778-A Insecticidal esters derived from benzocycloalkane-thiophenemethyl compounds FMC CORPORATION (US) 1984-12-11 — — US claimed
US-4451484-A ALSO MITICIDES FMC CORPORATION (US) 1984-05-29 — — US claimed
EP-0049977-A1 Insecticidal (1,1'-biphenyl)-3-ylmethyl esters, their production and use and compositions containing them FMC Corporation (US) 1982-04-21 — — EP claimed
US-7566683-B2 Ethylene derivatives and pesticides containing said derivatives NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-07-28 — — US disclosed
WO-2007100161-A1 METHOD FOR PREFERENTIAL PRODUCTION OF GEOMETRIC ISOMERS AND ISOLATION METHOD NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-09-07 — — WO disclosed
US-20070049495-A1 Ethylene derivatives and pesticides containing said derivatives NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-03-01 — — US disclosed
US-7037880-B2 Ethylene derivatives and pesticides containing said derivatives NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2006-05-02 — — US disclosed
CN-1141300-C Acrylonitrile compounds �ղ���ѧ��ҵ��ʽ���� 2004-03-10 — — CN disclosed
US-20030216394-A1 Etylene derivatives and pesticides containing said derivatives NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-11-20 — — US disclosed
US-4493844-A Insecticidal 2,2'-bridged(1,1'-biphenyl)-3-ylmethyl carboxamides FMC CORPORATION (US) 1985-01-15 — — US disclosed
US-4487778-A Insecticidal esters derived from benzocycloalkane-thiophenemethyl compounds FMC CORPORATION (US) 1984-12-11 — — US disclosed
US-4451484-A ALSO MITICIDES FMC CORPORATION (US) 1984-05-29 — — US disclosed
US-4433182-A Insecticidal 2,2'-bridged[1,1'-biphenyl]-3-ylmethyl esters FMC CORPORATION (US) 1984-02-21 — — US disclosed
US-4402973-A Insecticidal (1,1'-biphenyl)-3-ylmethyl esters FMC CORPORATION (US) 1983-09-06 — — US disclosed
US-4329518-A INSECTICIDES, ACARICIDES, MITICIDES FMC CORPORATION (US) 1982-05-11 — — US disclosed
EP-0049977-A1 Insecticidal (1,1'-biphenyl)-3-ylmethyl esters, their production and use and compositions containing them FMC Corporation (US) 1982-04-21 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030216394-A1 Etylene derivatives and pesticides containing said derivatives DDT, ECE1, EBPL NQO1 660/4885TSHR 297/4885TDP1 543/4885
US-20070049495-A1 Ethylene derivatives and pesticides containing said derivatives DDT, ECE1, EBPL NQO1 945/4885TSHR 406/4885TDP1 1011/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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