SCHEMBL2774035

SCHEMBL2774035

CC(C)(C)OC(=O)N1CCCCC1Cc1csc(-c2ccc(Cl)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.42
UCHL1 P09936 1/20 0.42
ALDH1A1 P00352 1/20 0.42
OPRK1 P41145 2/20 0.41
APP P05067 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
DRD2 P14416 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
SLC6A2 P23975 1/20 0.41
HRH2 P25021 1/20 0.41
HTR1D P28221 1/20 0.41
HTR1B P28222 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR7 P34969 1/20 0.41
DRD3 P35462 1/20 0.41
HTR2B P41595 1/20 0.41
PSEN1 P49768 1/20 0.41

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
SCHEMBL22036268 0.84 HPGD (0.49) ALDH1A1OPRK1APPHTR1AADRA2A
SCHEMBL2775887 0.81 STS (0.46) HPGDMEN1LMNAMAPTKMT2A
SCHEMBL10132293 0.81 ALDH1A1 (0.51) ALDH1A1OPRK1APPHTR1AADRA2A
SCHEMBL8211106 0.78 GPR119 (0.47) USP30UCHL1DRD2HTR2AKDM1A
SCHEMBL10132370 0.77 ALDH1A1 (0.50) USP30UCHL1ALDH1A1NR1H2NR1H3
SCHEMBL6990776 0.77 STS (0.48) ALDH1A1OPRK1APPHTR1AADRA2A
SCHEMBL18608053 0.77 MEN1 (0.45) ALDH1A1OPRK1APPHTR1AADRA2A
SCHEMBL18609579 0.77 MEN1 (0.45) ALDH1A1OPRK1APPHTR1AADRA2A
SCHEMBL982003 0.76 CHEK1 (0.46) USP30UCHL1ALDH1A1OPRK1APP
Hydrochloric Acid SCHEMBL27768333 0.76 CHEK1 (0.45) USP30UCHL1ALDH1A1OPRK1APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2241569-B1 THIENOPYRIDAZINE COMPOUNDS, THEIR PREPARATIONS, PHARMACEUTICAL COMPOSITIONS AND USES ZHEJIANG MED XINCHANG PHARM (CN) 2012-05-23 EP disclosed
EP-2241569-A1 THIENOPYRIDAZINE COMPOUNDS, THEIR PREPARATIONS, PHARMACEUTICAL COMPOSITIONS AND USES Zhejiang Medicine Co., Ltd. Xinchang Pharmaceutical Factory (CN) 2010-10-20 EP disclosed