SCHEMBL395370

SCHEMBL395370

O=C(NC1CCCCC1)c1cc2ccccc2s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.60
HDAC4 P56524 1/20 0.60
HDAC1 Q13547 1/20 0.60
HDAC7 Q8WUI4 1/20 0.60
HDAC2 Q92769 1/20 0.60
HDAC10 Q969S8 1/20 0.60
HDAC11 Q96DB2 1/20 0.60
HDAC8 Q9BY41 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
HDAC9 Q9UKV0 1/20 0.60
HDAC5 Q9UQL6 1/20 0.60
RAB9A P51151 5/20 0.59
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.59
OPRM1 P35372 1/20 0.59
CHRNA7 P36544 4/20 0.58
HTR3A P46098 3/20 0.58
HTR3E A5X5Y0 1/20 0.58
HTR3B O95264 1/20 0.58
HTR3D Q70Z44 1/20 0.58

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
SCHEMBL6093432 0.86 RAB9A (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6093435 0.86 RAB9A (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL30241129 0.86 RAB9A (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17163822 0.86 HDAC3 (0.57) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL18270647 0.84 CHRNA1 (0.69) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13303601 0.84 CHRNA1 (0.69) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8306899 0.82 CHRNA7 (0.58) RAB9AKMT2AMEN1CHRNA7HTR3A
SCHEMBL27917784 0.80 CHRNA7 (0.58) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL7484068 0.79 TMIGD3 (0.56) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8751253 0.79 FAAH (0.63) RAB9AMAOBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020066879-A1 Active compound combinations for protecting animal hides and leather LANXESS DEUTSCHLAND GMBH (DE) 2002-06-06 US claimed
WO-1999015015-A1 MIXTURE OF BENZOTHIOPHENE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1999-04-01 WO claimed
EP-0714420-B1 MOULD-RESISTANT EMULSION PAINTS BAYER AG (DE) 1997-11-05 EP claimed
US-5622546-A Mould-resistant emulsion paints BAYER AKTIENGESELLSCHAFT (DE) 1997-04-22 US claimed
EP-0714420-A1 MOULD-RESISTANT EMULSION PAINTS BAYER AG (DE) 1996-06-05 EP claimed
WO-1995006091-A1 MOULD-RESISTANT EMULSION PAINTS BAYER AKTIENGESELLSCHAFT (DE) 1995-03-02 WO claimed
US-20230337680-A1 PENFLUFEN AS A WOOD PRESERVATIVE AGAINST WOOD-DESTROYING BASIDIOMYCETES LANXESS DEUTSCHLAND GMBH (DE) 2023-10-26 US disclosed
CN-108077275-B Fungicidal penflufen mixtures 朗盛德国有限责任公司 2021-04-30 CN disclosed
US-10231459-B2 Penflufen as a wood preservative against wood-destroying basidiomycetes LANXESS DEUTSCHLAND GMBH (DE) 2019-03-19 US disclosed
US-9951205-B2 Stable compositions of thiabendazole and iodine-containing fungicides LANXESS DEUTSCHLAND GMBH (DE) 2018-04-24 US disclosed
US-20170215423-A1 Active Substance Combination Based on Trifluorobutinyl Compounds and Exhibiting Nematicidal and Insecticidal Properties ADAMA MAKHTESHIM LTD. (IL) 2017-08-03 US disclosed
US-9681662-B2 Active substance combination based on trifluorobutinyl compounds and exhibiting nematicidal and insecticidal properties ADAMA MAKHTESHIM LTD. (IL) 2017-06-20 US disclosed
US-9596854-B2 Fungicidal penflufen mixtures LANXESS DEUTSCHLAND GMBH (DE) 2017-03-21 US disclosed
US-6217642-B1 PROTECTING AN OBJECT FROM FOULING BY THE SPECIES SELECTED FROM THE GROUP CONSISTING OF LEPADOMORPHA, BALANOMORPHA AND SESSILE ENTOMOSTRACA COMPRISING APPLYING TO THE OBJECT BENZOTHIOPHENE-2-CABOXAMIDE S,S-DIOXIDES ANTIFOULING AGENT BAYER AKTIENGESELLSCHAFT (DE) 2001-04-17 US disclosed
EP-1022949-A1 SYNERGISTIC COMPOSITIONS COMPRISING AN OXATHIAZINE AND A BENZOTHIOPHENE-2-CARBOXAMIDE-S,S-DIOXIDE JANSSEN PHARMACEUTICA N.V. (BE) 2000-08-02 EP disclosed
US-6075019-A Arylthio-dithiazindioxides and their use as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2000-06-13 US disclosed
EP-0969721-A1 FUNGICIDAL BENZOTHIOPHENE-2-CARBOXAMIDE-S,S-DIOXIDES FOR COOLING LUBRICANTS BAYER AG (DE) 2000-01-12 EP disclosed
WO-1999018795-A1 SYNERGISTIC COMPOSITIONS COMPRISING AN OXATHIAZINE AND A BENZOTHIOPHENE-2-CARBOXAMIDE-S,S-DIOXIDE JANSSEN PHARMACEUTICA N.V. (BE) 1999-04-22 WO disclosed
WO-1998039968-A1 FUNGICIDAL BENZOTHIOPHENE-2-CARBOXAMIDE-S,S-DIOXIDES FOR COOLING LUBRICANTS BAYER AKTIENGESELLSCHAFT (DE) 1998-09-17 WO disclosed
US-5622546-A Mould-resistant emulsion paints BAYER AKTIENGESELLSCHAFT (DE) 1997-04-22 US 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 (3 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-20230337680-A1 PENFLUFEN AS A WOOD PRESERVATIVE AGAINST WOOD-DESTROYING BASIDIOMYCETES BLVRB, DCXR, PAH HDAC3 1845/4885HDAC4 1956/4885HDAC1 1388/4885
US-10231459-B2 Penflufen as a wood preservative against wood-destroying basidiomycetes BLVRB, DCXR, PAH HDAC3 1845/4885HDAC4 1956/4885HDAC1 1388/4885
US-20170215423-A1 Active Substance Combination Based on Trifluorobutinyl Compounds and Exhibiting Nematicidal and Insecticidal Properties ACHE, DDT, NGLY1 HDAC3 315/4885HDAC4 795/4885HDAC1 586/4885

“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.