SCHEMBL1730438

SCHEMBL1730438

CCCCCCCCCCCCCCCCN(C)C.CCCCCCCCCCCCCCN(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 1.00
TSHR P16473 2/20 0.73
ALDH1A1 P00352 1/20 0.73
THRB P10828 1/20 0.53
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
S1PR2 O95136 1/20 0.43
S1PR1 P21453 1/20 0.43
S1PR3 Q99500 1/20 0.43
S1PR5 Q9H228 1/20 0.43
GBA1 P04062 1/20 0.41
SIGMAR1 Q99720 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
SCHEMBL119304 1.00 DNM1 (1.00) DNM1TSHRALDH1A1THRBCA12
SCHEMBL9807721 1.00 DNM1 (1.00) DNM1TSHRALDH1A1THRBCA12
SCHEMBL9807726 1.00 DNM1 (1.00) DNM1TSHRALDH1A1THRBCA12
SCHEMBL284680 1.00 DNM1 (1.00) DNM1TSHRALDH1A1THRBCA12
SCHEMBL9436929 1.00 DNM1 (1.00) DNM1TSHRALDH1A1THRBCA12
SCHEMBL9807727 1.00 DNM1 (1.00) DNM1TSHRALDH1A1THRBCA12
SCHEMBL25269808 1.00 DNM1 (1.00) DNM1TSHRALDH1A1THRBCA12
SCHEMBL754512 1.00 DNM1 (1.00) DNM1TSHRALDH1A1THRBCA12
Dymanthine SCHEMBL61784 1.00 DNM1 (1.00) DNM1TSHRALDH1A1THRBCA12
SCHEMBL10407867 1.00 DNM1 (1.00) DNM1TSHRALDH1A1THRBCA12

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-1389133-B1 METHODS FOR INACTIVATING VIRUSES ORGANON NV (NL) 2011-11-23 EP claimed
EP-3734626-A1 LIQUID DISPERSION COMPOSITION FOR SOLID ELECTROLYTIC CAPACITOR PRODUCTION, AND PRODUCTION METHOD FOR SOLID ELECTROLYTIC CAPACITOR Showa Denko K.K. (JP) 2020-11-04 EP disclosed