SCHEMBL4535644

SCHEMBL4535644

O=C(O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCNC(=S)S

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.63
ADRA1A P35348 1/20 0.59
MAPK1 P28482 1/20 0.52
EPHX2 P34913 7/20 0.50
LMNA P02545 2/20 0.50
TSHR P16473 1/20 0.50
NFKB1 P19838 1/20 0.50
PMP22 Q01453 1/20 0.50
PLA2G2A P14555 1/20 0.49
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
EPHX1 P07099 1/20 0.45
PLA2G4A P47712 1/20 0.44

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
SCHEMBL4528600 1.00 PRMT1 (0.63) PRMT1ADRA1AMAPK1EPHX2LMNA
SCHEMBL4534891 1.00 PRMT1 (0.63) PRMT1ADRA1AMAPK1EPHX2LMNA
SCHEMBL4535119 1.00 PRMT1 (0.63) PRMT1ADRA1AMAPK1EPHX2LMNA
SCHEMBL4535582 1.00 PRMT1 (0.63) PRMT1ADRA1AMAPK1EPHX2LMNA
SCHEMBL4535780 1.00 PRMT1 (0.63) PRMT1ADRA1AMAPK1EPHX2LMNA
SCHEMBL4529694 1.00 PRMT1 (0.63) PRMT1ADRA1AMAPK1EPHX2LMNA
SCHEMBL4531368 1.00 PRMT1 (0.63) PRMT1ADRA1AMAPK1EPHX2LMNA
SCHEMBL4534636 1.00 PRMT1 (0.63) PRMT1ADRA1AMAPK1EPHX2LMNA
SCHEMBL4530021 1.00 PRMT1 (0.63) PRMT1ADRA1AMAPK1EPHX2LMNA
SCHEMBL4532931 1.00 PRMT1 (0.63) PRMT1ADRA1AMAPK1EPHX2LMNA

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
US-20090123516-A1 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS-THERAPEUTIC SAMS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2009-05-14 US disclosed