SCHEMBL7761124

SCHEMBL7761124

O=C(O)CCCNC(=S)S

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.50
ADRA1A P35348 1/20 0.47
ALDH1A1 P00352 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
CYP2C19 P33261 1/20 0.44
HSD17B10 Q99714 1/20 0.44
LMNA P02545 3/20 0.43
SLC22A6 Q4U2R8 1/20 0.43
ATM Q13315 1/20 0.43
PLA2G4A P47712 1/20 0.43
EPHX2 P34913 3/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
PMP22 Q01453 1/20 0.42
FABP4 P15090 1/20 0.42
MAPK1 P28482 1/20 0.41
FOLH1 Q04609 1/20 0.41
CA1 P00915 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
SCHEMBL10780773 0.93 PRMT1 (0.59) PRMT1ADRA1AALDH1A1CYP2C9HPGD
SCHEMBL4535119 0.91 PRMT1 (0.63) PRMT1ADRA1ACYP2C9CYP2C19LMNA
SCHEMBL4528600 0.91 PRMT1 (0.63) PRMT1ADRA1ACYP2C9CYP2C19LMNA
SCHEMBL4535582 0.91 PRMT1 (0.63) PRMT1ADRA1ACYP2C9CYP2C19LMNA
SCHEMBL4535644 0.91 PRMT1 (0.63) PRMT1ADRA1ACYP2C9CYP2C19LMNA
SCHEMBL4534636 0.91 PRMT1 (0.63) PRMT1ADRA1ACYP2C9CYP2C19LMNA
SCHEMBL4535780 0.91 PRMT1 (0.63) PRMT1ADRA1ACYP2C9CYP2C19LMNA
SCHEMBL4531368 0.91 PRMT1 (0.63) PRMT1ADRA1ACYP2C9CYP2C19LMNA
SCHEMBL4530021 0.91 PRMT1 (0.63) PRMT1ADRA1ACYP2C9CYP2C19LMNA
SCHEMBL4529694 0.91 PRMT1 (0.63) PRMT1ADRA1ACYP2C9CYP2C19LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0596037-B1 RADIOPHARMACEUTICAL PRODUCT HAVING IN PARTICULAR A CEREBRAL TROPISM COMPRISING A TRANSITION METAL NITRIDE COMPLEX, AND PREPARATION METHOD THEREFOR CIS BIO INT (FR) 2001-05-02 EP claimed