SCHEMBL7609667

SCHEMBL7609667

C=C(OCCO)C(=O)CCSC(C)=O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.34
TSHR P16473 1/20 0.34
POLB P06746 1/20 0.33
BLM P54132 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL8719563 0.79 MGLL (0.39) CYP2C19TSHRPOLBBLMATM
SCHEMBL7614910 0.73 TSHR (0.39) TSHR
SCHEMBL20466232 0.70 DGKA (0.47) TSHR
SCHEMBL252209 0.69
SCHEMBL16239361 0.69
SCHEMBL15890590 0.69 TSHR (0.46) CYP2C19TSHRPOLBBLMATM
SCHEMBL997382 0.67 MEN1 (0.48) CYP2C19TSHRPOLBBLMATM
SCHEMBL888204 0.67 MEN1 (0.48) CYP2C19TSHRPOLBBLMATM
SCHEMBL26381747 0.67 MEN1 (0.48) CYP2C19TSHRPOLBBLMATM
SCHEMBL13301154 0.67 MEN1 (0.48) CYP2C19TSHRPOLBBLMATM

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-20020061602-A1 Hybrid phthalocyanine derivatives and their uses GENERAL ELECTRIC CAPITAL CORPORATION, AS AGENT 2002-05-23 US disclosed