SCHEMBL4336784

SCHEMBL4336784

N#CCc1cccc(Oc2ccccc2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.43
▸ F2 P00734 3/20 0.41
▸ F10 P00742 3/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ PRSS3 P35030 1/20 0.39
▸ ST14 Q9Y5Y6 1/20 0.39
▸ MAP4K4 O95819 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36

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
Water SCHEMBL9667106 1.00 SMN1; SMN2 (0.43) SMN1; SMN2F2F10KCNH2MEN1
SCHEMBL10548817 0.83 KCNH2 (0.41) SMN1; SMN2F2F10KCNH2PRSS1
SCHEMBL9577114 0.81 KCNH2 (0.46) SMN1; SMN2F2F10KCNH2PRSS1
SCHEMBL2521152 0.78 LTA4H (0.58) SMN1; SMN2F2F10MEN1KMT2A
SCHEMBL9519763 0.77 KCNH2 (0.44) SMN1; SMN2F2F10KCNH2MEN1
SCHEMBL9714305 0.77 KCNH2 (0.44) SMN1; SMN2F2F10KCNH2MEN1
SCHEMBL1680925 0.77 LOXL2 (0.47) F2F10KCNH2PRSS1PRSS2
SCHEMBL17391197 0.77 KDM1A (0.41) MEN1KMT2AMAPTTDP1
SCHEMBL11175776 0.77 KCNH2 (0.44) SMN1; SMN2F2F10KCNH2MEN1
SCHEMBL9198043 0.77 KCNH2 (0.44) SMN1; SMN2F2F10KCNH2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0237227-A1 Insecticidal compositions IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-09-16 — — EP claimed
EP-0108679-B1 DERIVATIVES OF CYCLOPROPANE-CARBOXYLIC ACID CONTAINING AN ALKYLTHIOCARBONYL GROUP AND A HALOGEN ATOM, THEIR PREPARATION, THEIR USE AS PARASITICIDES FOR PLANTS, ANIMALS AND PREMISES, AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1986-02-19 — — EP claimed
EP-0145179-A1 Halo((phenoxypyridyl)methyl)esters, process for their preparation and their use as insecticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-06-19 — — EP claimed
EP-0041021-B1 CYCLOPROPANE CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION, THEIR USE AGAINST PARASITES IN PLANTS AND ANIMALS, THEIR COMPOSITIONS AND THEIR INTERMEDIATES ROUSSEL-UCLAF (FR) 1984-07-25 — — EP claimed
EP-0027011-B1 INSECTICIDAL SYNERGISTIC MIXTURES OF 0,0-DIETHYL 0-(3,5,6-TRICHLORO-2-PYRIDINYL) PHOSPHOROTHIOATE AND 3-(2,2-DICHLOROETHENYL)-2,2-DIMETHYL-CYCLOPROPANE CARBOXYLIC ACID: CYANO (6-PHENOXY-2-PYRIDINYL) METHYL ESTER AND METHOD OF KILLING AND CONTROLLING INSECTS THE DOW CHEMICAL COMPANY (US) 1983-06-29 — — EP claimed
EP-0037851-A2 Carboxylates, a process for their production, an insecticidal and/or acaricidal composition and the use of the compounds as insecticides and/or acaricides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-10-21 — — EP claimed
EP-2048953-B1 INSECTICIDAL COMPOSITION MCLAUGHLIN GORMLEY KING CO (US) 2020-11-18 — — EP disclosed
US-20090324509-A1 INSECTICIDAL COMPOSITION LIVIE BIOPESTICIDES LIMITED (GB) 2009-12-31 — — US disclosed
US-20090263511-A1 INSECTICIDAL COMPOSITION LIVIE BIOPESTICIDES LIMITED (GB) 2009-10-22 — — US disclosed
WO-2005087742-A1 METABOLIC KINASE MODULATORS AND METHODS OF USE AS PESTICIDES EXELIXIS, INC. (US) 2005-09-22 — — WO disclosed
US-4883806-A ACARICIDES ROUSSEL UCLAF (FR) 1989-11-28 — — US disclosed
US-4833163-A INSECTICIDES, NEMATOCIDES, MITICIDES ROUSSEL UCLAF (FR) 1989-05-23 — — US disclosed
EP-0237227-A1 Insecticidal compositions IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-09-16 — — EP disclosed
EP-0162538-A2 Cyclopropane derivates IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-11-27 — — EP disclosed
US-4542142-A Insecticidal cyclopropane carboxylic acid derivatives with 3-unsaturated-side chain ROUSSEL UCLAF (FR) 1985-09-17 — — US disclosed
EP-0145179-A1 Halo((phenoxypyridyl)methyl)esters, process for their preparation and their use as insecticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-06-19 — — EP disclosed
US-4491585-A Combating pests with novel phenoxypyridylmethyl esters BAYER AKTIENGESELLSCHAFT (DE) 1985-01-01 — — US disclosed
EP-0037851-A2 Carboxylates, a process for their production, an insecticidal and/or acaricidal composition and the use of the compounds as insecticides and/or acaricides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-10-21 — — EP disclosed
EP-0026650-A3 INSECTICIDAL SYNERGISTIC MIXTURES OF 0,0-DIETHYL 0-(3,5,6-TRICHLORO-2-PYRIDINYL)PHOSPHOROTHIOATE AND 4-CHLORO-ALPHA-(1-METHYLETHYL)BENZENE-ACETIC ACID:CYANO(6-PHENOXY-2-PYRIDINYL)METHYL ESTER AND METHOD OF KILLING AND CONTROLLING INSECTS THE DOW CHEMICAL COMPANY (US) 1981-04-22 — — EP disclosed
EP-0026650-A2 Insecticidal synergistic mixtures of 0,0-diethyl 0-(3,5,6-trichloro-2-pyridinyl)phosphorothioate and 4-chloro-alpha-(1-methylethyl)benzene-acetic acid:cyano(6-phenoxy-2-pyridinyl)methyl ester and method of killing and controlling insects THE DOW CHEMICAL COMPANY (US) 1981-04-08 — — EP disclosed
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