SCHEMBL3575673

SCHEMBL3575673

CC(N=C=S)(c1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
CYP19A1 P11511 2/20 0.39
KIF11 P52732 2/20 0.38
BCL2 P10415 1/20 0.36
CHRM2 P08172 2/20 0.35
HTR1A P08908 2/20 0.35
ADRA2A P08913 2/20 0.35
CHRM1 P11229 2/20 0.35
DRD1 P21728 2/20 0.35
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
ADRA1A P35348 2/20 0.35
OPRM1 P35372 2/20 0.35
DRD3 P35462 2/20 0.35
SLC6A3 Q01959 2/20 0.35
KCNH2 Q12809 2/20 0.35
HRH3 Q9Y5N1 2/20 0.35
TBXA2R P21731 1/20 0.35
ACHE P22303 1/20 0.35

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
SCHEMBL6889221 0.89 MIF (0.39) KMT2ATSHRALDH1A1ALOX15ESR1
SCHEMBL10154525 0.74 KMT2A (0.38) KMT2AMEN1CYP19A1BCL2SLC6A2
SCHEMBL8763183 0.72 MIF (0.39) KMT2ATSHRALDH1A1ALOX15ESR1
SCHEMBL2241061 0.72 MIF (0.39) KMT2ATSHRALDH1A1ALOX15ESR1
SCHEMBL25039218 0.72 KMT2A (0.52) KMT2AMEN1CYP19A1KIF11BCL2
SCHEMBL9317593 0.72 ESR1 (0.60) KMT2AMEN1CYP19A1KIF11BCL2
SCHEMBL10838797 0.72 CYP19A1 (0.64) KMT2AMEN1CYP19A1KIF11BCL2
SCHEMBL25119687 0.69 CYP19A1 (0.37) KMT2AMEN1CYP19A1KCNH2TSHR
SCHEMBL4062666 0.69 KMT2A (0.82) KMT2AMEN1CYP19A1KIF11BCL2
SCHEMBL16144309 0.69 KMT2A (0.82) KMT2AMEN1CYP19A1KIF11BCL2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1713786-B1 1-(AZOLIN-2-YL) AMINO-1,2-DIPHENYLETHANE COMPOUNDS FOR COMBATTING INSECTS, ARACHNIDS AND NEMATODES BASF SE (DE) 2012-08-08 EP disclosed
US-7655600-B2 4,5-Dihydro-4-methyloxazol-2-yl)-[2-(3-chloro-phenyl)-1-phenyl-ethyl]-amine; 1-[1-(4-Chlorophenyl)-2-phenyl-ethyl]-(4,5-dihydrothiazol-2-yl)-amine; animal pests; agriculture; broad activity spectrum against difficult to control insects etc. BASF AKTIENGESELLSCHAFT (DE) 2010-02-02 US disclosed
US-20080161403-A1 1-(1,2 Diphenyl-Ethyl)-3-(2-Hydroxyethyl)-Thiourea Compounds For Combating Animal Pests BASF AKTIENGESELLSCHAFT (DE) 2008-07-03 US disclosed
EP-1890541-A2 1-(1,2-DIPHENYL-ETHYL)-3-(2-HYDROXYETHYL)-THIOUREA COMPOUNDS FOR COMBATING ANIMAL PESTS BASF AKTIENGESELLSCHAFT (DE) 2008-02-27 EP disclosed
US-20070149582-A1 1-(Azolin-2-yl)amino-1,2-diphenylethane compounds for combating insects, arachnids and nematodes BASF AKTIENGESELLSCHAFT (DE) 2007-06-28 US disclosed
WO-2006125745-A2 1-(1,2-DIPHENYL-ETHYL)-3-(2-HYDROXYETHYL)-THIOUREA COMPOUNDS FOR COMBATING ANIMAL PESTS BASF AKTIENGESELLSCHAFT (DE) 2006-11-30 WO disclosed
EP-1713786-A1 1-(AZOLIN-2-YL) AMINO-1,2-DIPHENYLETHANE COMPOUNDS FOR COMBATTING INSECTS, ARACHNIDS AND NEMATODES BASF AKTIENGESELLSCHAFT (DE) 2006-10-25 EP disclosed
WO-2005063724-A1 1-(AZOLIN-2-YL) AMINO-1,2-DIPHENYLETHANE COMPOUNDS FOR COMBATTING INSECTS, ARACHNIDS AND NEMATODES BASF AKTIENGESELLSCHAFT (DE) 2005-07-14 WO 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-20070149582-A1 1-(Azolin-2-yl)amino-1,2-diphenylethane compounds for combating insects, arachnids and nematodes ANXA1, ANTXR2, ANXA2 KMT2A 1285/4885MEN1 1710/4885CYP19A1 1404/4885
US-20080161403-A1 1-(1,2 Diphenyl-Ethyl)-3-(2-Hydroxyethyl)-Thiourea Compounds For Combating Animal Pests H1-10, H1-3, H1-0 KMT2A 2322/4885MEN1 3839/4885CYP19A1 4798/4885

“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.