Butane

Butane

SCHEMBL677651

CC1(C(=O)O)CC(C(=O)O)=NN1c1ccc(Cl)cc1Cl.CCCC

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
NOTUM Q6P988 3/20 0.38
RPA1 P27694 1/20 0.36
CYP11B2 P19099 1/20 0.36
GABRA2 P47869 4/20 0.36
GABRB2 P47870 4/20 0.36
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
GRM5 P41594 1/20 0.35
MARS1 P56192 1/20 0.34
CNR2 P34972 3/20 0.34
CNR1 P21554 1/20 0.34
NPC1 O15118 1/20 0.34

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
Butane SCHEMBL20916981 1.00 LMNA (0.42) LMNANOTUMRPA1CYP11B2GABRA2
SCHEMBL29686790 0.95 LMNA (0.45) LMNANOTUMRPA1CYP11B2GABRA2
SCHEMBL471146 0.95 LMNA (0.45) LMNANOTUMRPA1CYP11B2GABRA2
SCHEMBL135365 0.95 LMNA (0.45) LMNANOTUMRPA1CYP11B2GABRA2
Butane SCHEMBL2697730 0.88 LMNA (0.34) LMNANOTUMGABRA2GABRB2GRM5
SCHEMBL19698080 0.87 LMNA (0.41) LMNANOTUMRPA1CYP11B2GABRA2
SCHEMBL6061258 0.86 GABRA2 (0.42) LMNAGABRA2GABRB2NPC1
SCHEMBL30684851 0.85 GABRA2 (0.47) GABRA2GABRB2NPC1
SCHEMBL3665939 0.85 GABRA2 (0.47) GABRA2GABRB2NPC1
SCHEMBL29419101 0.85 GABRA2 (0.42) LMNANOTUMGABRA2GABRB2OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4742898-A1 HERBICIDE SAFENER COMBINATIONS AND COMPOSITIONS UPL Mauritius Limited (MU) 2026-05-20 EP claimed
EP-4687441-A1 OIL DISPERSION COMPOSITIONS AND USES THEREOF Adama Agan Ltd. (IL) 2026-02-11 EP claimed
US-20250311689-A1 SEEDLING GERMINATION AND GROWTH CONDITIONS PIONEER HI-BRED INTERNATIONAL, INC. (US) 2025-10-09 US claimed
WO-2025041051-A1 HERBICIDE SAFENER COMPOSITION UPL MAURITIUS LIMITED (MU) 2025-02-27 WO claimed
WO-2025012825-A1 HERBICIDE SAFENER COMBINATIONS AND COMPOSITIONS UPL MAURITIUS LIMITED (MU) 2025-01-16 WO claimed
WO-2024201462-A1 OIL DISPERSION COMPOSITIONS AND USES THEREOF ADAMA AGAN LTD. (IL) 2024-10-03 WO claimed
WO-2023056236-A1 SEEDLING GERMINATION AND GROWTH CONDITIONS PIONEER HI-BRED INTERNATIONAL, INC. (US) 2023-04-06 WO claimed
EP-3898612-A1 SUBSTITUTED PYRIDINYLOXYBENZENES AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL AGENTS Bayer Aktiengesellschaft (DE) 2021-10-27 EP claimed
EP-3810589-A1 SUBSTITUTED 2-HETEROARYLOXYPYRIDINES AND SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS Bayer Aktiengesellschaft (DE) 2021-04-28 EP claimed
EP-3810588-A1 SUBSTITUTED 4-HETEROARYLOXYPYRIDINES AND SALTS THEREOF AND THEIR USE AS HERBICIDAL AGENTS Bayer Aktiengesellschaft (DE) 2021-04-28 EP claimed
US-20140213449-A1 NOVEL COMPLEX FOR USE IN STABILIZING HERBICIDAL COMPOSITIONS AND METHODS FOR SYNTHESIZING AND USING THE SAME BAYER CROPSCIENCE LP (US) 2014-07-31 US claimed
US-8642508-B2 Complex for use in stabilizing herbicidal compositions and methods for synthesizing and using BAYER CROPSCIENCE LP (US) 2014-02-04 US claimed
EP-2672825-A1 STABLE AGROCHEMICAL OIL DISPERSIONS Dow AgroSciences LLC (US) 2013-12-18 EP claimed
WO-2012108873-A1 STABLE AGROCHEMICAL OIL DISPERSIONS DOW AGROSCIENCES LLC (US) 2012-08-16 WO claimed
US-20120208700-A1 STABLE AGROCHEMICAL OIL DISPERSIONS DOW AGROSCIENCES LLC (US) 2012-08-16 US claimed
CN-102471311-A Herbicidally active heteroaryl-substituted cyclic diones or derivatives thereof SYNGENTA LTD 2012-05-23 CN claimed
US-20120108424-A1 Novel complex for use in stabilizing herbicidal compositions and merthods for synthesizing and using the same BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2012-05-03 US claimed
EP-1965643-A2 NOVEL COMPLEX FOR USE IN STABILIZING HERBICIDAL COMPOSITIONS AND METHODS FOR SYNTHESIZING AND USING THE SAME Bayer Cropscience LP (US) 2008-09-10 EP claimed
WO-2007067472-A2 NOVEL COMPLEX FOR USE IN STABILIZING HERBICIDAL COMPOSITIONS AND METHODS FOR SYNTHESIZING AND USING THE SAME BAYER CROPSCIENCE LP (US) 2007-06-14 WO claimed
WO-2000011954-A1 HERBICIDAL METHOD AVENTIS CROPSCIENCE S.A. (FR) 2000-03-09 WO claimed

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-20120208700-A1 STABLE AGROCHEMICAL OIL DISPERSIONS SORD, DDT, SBDS LMNA 2360/4885NOTUM 163/4885RPA1 2267/4885
US-20120108424-A1 Novel complex for use in stabilizing herbicidal compositions and merthods for synthesizing and using the same DDT, AS3MT, ACHE LMNA 4527/4885NOTUM 23/4885RPA1 4138/4885
US-20140213449-A1 NOVEL COMPLEX FOR USE IN STABILIZING HERBICIDAL COMPOSITIONS AND METHODS FOR SYNTHESIZING AND USING THE SAME DDT, AS3MT, CBR3 LMNA 4332/4885NOTUM 58/4885RPA1 4144/4885

“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.