SCHEMBL7660358

SCHEMBL7660358

CNC(=O)N(C)SCc1ccccn1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
CYP1A2 P05177 2/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
ALOX15 P16050 1/20 0.41
GAA P10253 1/20 0.40
CYP2C19 P33261 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL7668271 0.76 KMT2A (0.43) ALDH1A1TSHRSMN1; SMN2TDP1GAA
SCHEMBL10159595 0.75 HIF1A (0.55) ALDH1A1SMN1; SMN2LMNATDP1HRH3
SCHEMBL12641827 0.75 EHMT2 (0.47) ALDH1A1SMN1; SMN2LMNATDP1ALOX15
SCHEMBL7667117 0.74 ALDH1A1 (0.41) ALDH1A1CYP1A2TSHRSMN1; SMN2LMNA
SCHEMBL11275099 0.73 SMN1; SMN2 (0.59) ALDH1A1TSHRSMN1; SMN2ALOX15GAA
SCHEMBL7669235 0.73 MAPK1 (0.35) ALDH1A1MAPK1SMN1; SMN2LMNAGAA
SCHEMBL11203112 0.73 ALDH1A1 (0.69) ALDH1A1CYP1A2TSHRMAPK1SMN1; SMN2
SCHEMBL10675218 0.72 SMN1; SMN2 (0.58) ALDH1A1CYP1A2TSHRMAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL10669700 0.72 SMN1; SMN2 (0.56) ALDH1A1CYP1A2TSHRMAPK1SMN1; SMN2
SCHEMBL7662025 0.70 KDM4E (0.49) ALDH1A1TSHRSMN1; SMN2LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407248-B1 INSECTICIDES, MITICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-18 US disclosed
US-6124297-A COMBATTING INSECTS OR MITES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-09-26 US disclosed
US-5935981-A INSECTICIDAL/MITICIDAL ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-08-10 US disclosed
US-5849768-A α-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-15 US disclosed
EP-0529680-B1 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-05-13 EP disclosed
EP-0302389-B1 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-22 EP disclosed
US-5214152-A Insecticides, miticides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-05-25 US disclosed
EP-0529680-A2 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-03-03 EP disclosed
US-5175301-A Insecticide, miticide, pesticide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-29 US disclosed
EP-0509559-A2 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-10-21 EP disclosed
EP-0302389-A2 Alpha-unsaturated amines, their production and use Takeda Chemical Industries, Ltd. (JP) 1989-02-08 EP disclosed