SCHEMBL3145510

SCHEMBL3145510

O=C(c1ccccc1CCl)c1ccccc1CCl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
TSHR P16473 3/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
FOLH1 Q04609 1/20 0.41
TP53 P04637 2/20 0.40
ALOX15 P16050 2/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
TRPA1 O75762 1/20 0.38
MAPK1 P28482 1/20 0.38
GSK3B P49841 1/20 0.38
HIF1A Q16665 1/20 0.38
HTT P42858 1/20 0.37
AKR1C3 P42330 1/20 0.37

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
SCHEMBL367932 0.87 L3MBTL1 (0.55) ALDH1A1TSHRL3MBTL1GAAMAPT
SCHEMBL12781509 0.85 CDC25B (0.59) L3MBTL1MAPTHTT
SCHEMBL602386 0.84 FOLH1 (0.59) ALDH1A1TSHRFOLH1TP53ALOX15
SCHEMBL152624 0.84 ALDH1A1 (0.50) ALDH1A1TSHRL3MBTL1FOLH1TP53
SCHEMBL8415153 0.82 LIG1 (0.59) ALDH1A1TSHRL3MBTL1SLC6A2SLC6A4
SCHEMBL5697535 0.82 NR4A1 (0.61) ALDH1A1L3MBTL1SLC6A2SLC6A4SLC6A3
Benzil SCHEMBL11761133 0.82 L3MBTL1 (0.51) ALDH1A1L3MBTL1GAAMAPTCES2
SCHEMBL11754245 0.82 FOLH1 (0.42) ALDH1A1TSHRL3MBTL1FOLH1TP53
SCHEMBL11721016 0.82 ALDH1A1 (0.50) ALDH1A1TSHRFOLH1ALOX15MAPT
SCHEMBL701634 0.82 ALDH1A1 (0.39) ALDH1A1TSHRL3MBTL1FOLH1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4059610-A Process for preparing isocyanic acid derivatives KAO SOAP CO., LTD. (JA) 1977-11-22 US claimed
EP-3186226-A1 OXIME SULFONATE DERIVATIVES BASF SE (DE) 2017-07-05 EP disclosed
WO-2016030790-A1 OXIME SULFONATE DERIVATIVES BASF SE (DE) 2016-03-03 WO disclosed
EP-2668156-A1 POLYMERIZABLE COMPOSITION COMPRISING AN OXIME SULFONATE AS THERMAL CURING AGENT BASF SE (DE) 2013-12-04 EP disclosed
WO-2012101245-A1 POLYMERIZABLE COMPOSITION COMPRISING AN OXIME SULFONATE AS THERMAL CURING AGENT BASF SE (DE) 2012-08-02 WO disclosed
US-7642357-B2 Iridium complexes TAKASAGO INTERNATIONAL CORPORATION (JP) 2010-01-05 US disclosed
US-20090036696-A1 IRIDIUM COMPLEXES TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-02-05 US disclosed
US-20030120088-A1 Optically active azetidincarboxamide-coordinated transition metal complexes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-06-26 US disclosed
EP-1319660-A1 Optically active azetidincarboxamide-coordinated transition metal complexes as catalysts in asymmetric reduction SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-06-18 EP disclosed
EP-0435687-B1 Process for isomerization of oxime ethers SUMITOMO CHEMICAL CO (JP) 1995-03-29 EP disclosed
US-5130486-A A ketoximine ether isomerized using a Lewis acid metal halide SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1992-07-14 US disclosed
EP-0485069-A1 Process for producing optically active amines SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-05-13 EP disclosed
EP-0435687-A2 Process for isomerization of oxime ethers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-07-03 EP disclosed
EP-0220792-B1 A METHOD FOR PRODUCING 2-ARYL-PROPIONALDEHYDES HAMARI YAKUHIN KOGYO KABUSHIKI KAISHA also known as HAMARI CHEMICALS, LTD. (JP) 1990-08-29 EP disclosed
EP-0220792-A1 A method for producing 2-aryl-propionaldehydes HAMARI YAKUHIN KOGYO KABUSHIKI KAISHA also known as HAMARI CHEMICALS, LTD. (JP) 1987-05-06 EP disclosed
US-4134809-A GLYCIDYL ACRYLATES, ADHESIVE METAL COATINGS EASTMAN KODAK COMPANY (US) 1979-01-16 US disclosed
US-4125552-A FROM A HALIDE, AMMONIA, HYDROCARBYLAMINE, HYDROGEN SULFIDE AND SULFUR DOW CORNING CORPORATION (US) 1978-11-14 US disclosed
US-4082790-A ORGANIC HALIDE, HYDROGEN SULFIDE, AMMONIA OR AMINE, POLAR SOLVENT DOW CORNING CORPORATION (US) 1978-04-04 US disclosed
US-4059447-A Photographic material containing oxazolinone-2 couplers AGFA-GEVAERT AKTIENGESELLSCHAFT (DT) 1977-11-22 US disclosed
US-4059610-A Process for preparing isocyanic acid derivatives KAO SOAP CO., LTD. (JA) 1977-11-22 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 (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-20090036696-A1 IRIDIUM COMPLEXES HAX1, MLX, H1-0 ALDH1A1 1340/4885TSHR 1743/4885L3MBTL1 187/4885
US-20030120088-A1 Optically active azetidincarboxamide-coordinated transition metal complexes AAAS, AP1M1, AP2A1 ALDH1A1 1300/4885TSHR 3830/4885L3MBTL1 1499/4885

“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.