SCHEMBL7778467

SCHEMBL7778467

CCOC(=O)N1CCCCN1C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
ALDH1A1 P00352 6/20 0.45
POLB P06746 1/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
THRB P10828 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 3/20 0.42
RECQL P46063 1/20 0.42
LMNA P02545 1/20 0.42
HSD17B10 Q99714 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALOX15 P16050 1/20 0.40
CTSK P43235 1/20 0.40
MGAM O43451 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
SOAT1 P35610 1/20 0.40

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
SCHEMBL7779646 0.91 TSHR (0.41) TSHRALDH1A1POLBHTTSMN1; SMN2
SCHEMBL11190071 0.89 ALDH1A1 (0.43) TSHRALDH1A1POLBHTTSMN1; SMN2
SCHEMBL10027108 0.88 TSHR (0.39) TSHRALDH1A1POLBHTTSMN1; SMN2
SCHEMBL11189598 0.86 ALDH1A1 (0.41) TSHRALDH1A1POLBHTTSMN1; SMN2
SCHEMBL10309528 0.82 TSHR (0.38) TSHRALDH1A1POLBHTTSMN1; SMN2
SCHEMBL9470186 0.82 CTSK (0.65) TSHRALDH1A1POLBHTTSMN1; SMN2
SCHEMBL3635136 0.80 TSHR (0.63) TSHRALDH1A1POLBHTTSMN1; SMN2
SCHEMBL2223429 0.80 TSHR (0.63) TSHRALDH1A1POLBHTTSMN1; SMN2
SCHEMBL675456 0.78 ALDH1A1 (0.61) TSHRALDH1A1POLBHTTSMN1; SMN2
SCHEMBL11402027 0.78 ALDH1A1 (0.61) TSHRALDH1A1POLBHTTSMN1; SMN2

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
EP-0693482-B1 PROCESS FOR PRODUCING HEXAHYDROPYRIDAZINE AND HEXAHYDROPYRIDAZINE-1,2-DICARBOXYLATE DERIVATIVE IHARA CHEMICAL IND CO (JP) 2001-09-12 EP disclosed
US-5874382-A Cyclic sulfonamide herbicides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1999-02-23 US disclosed
US-5750471-A PREEMERGENCE, POSTEMERGENCE HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1998-05-12 US disclosed
US-5739329-A Process for producing hexahydropyridazine and hexahydropyridazine-1,2-dicarboxy derivative IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1998-04-14 US disclosed
EP-0765324-A1 CYCLIC SULFONAMIDE HERBICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-04-02 EP disclosed
EP-0693482-A1 PROCESS FOR PRODUCING HEXAHYDROPYRIDAZINE AND HEXAHYDROPYRIDAZINE-1,2-DICARBOXYLATE DERIVATIVE IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) 1996-01-24 EP disclosed
WO-1995033746-A1 CYCLIC SULFONAMIDE HERBICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-12-14 WO disclosed
US-5039331-A Condensed heterocyclic derivatives and herbicides NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1991-08-13 US disclosed
US-4906281-A Herbicidal 9-arylimino-8-thia-1,6-diazabicyclo [4.3.0]nonane-7-ones (and thiones) FMC CORPORATION (US) 1990-03-06 US disclosed
EP-0304920-A2 Condensed heterocyclic derivatives, process for their production and herbicides NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1989-03-01 EP disclosed
US-4128425-A PYRAZOLIDINONE DERIVATIVES POLAROID CORPORATION (US) 1978-12-05 US disclosed