SCHEMBL10974704

SCHEMBL10974704

CCCC(C)CSCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.41
METAP2 P50579 1/20 0.39
POLB P06746 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 2/20 0.38
PRMT1 Q99873 1/20 0.38
S100A4 P26447 1/20 0.38
SIGMAR1 Q99720 2/20 0.37
CYP2C9 P11712 1/20 0.37
TP53 P04637 1/20 0.37
SLC6A4 P31645 1/20 0.37

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
SCHEMBL20408407 0.86 ACE (0.46) ACEMETAP2CYP1A2CYP3A4CYP2D6
SCHEMBL9906423 0.85 ACE (0.43) ACEMETAP2CYP1A2CYP3A4CYP2D6
SCHEMBL31513086 0.80 SIGMAR1 (0.40) ACEMETAP2POLBCYP1A2CYP3A4
SCHEMBL16181502 0.79 TRPA1 (0.46) ACEMETAP2CYP1A2CYP3A4CYP2D6
SCHEMBL24180375 0.78 MAPT (0.39) ACEMETAP2CYP1A2CYP3A4CYP2D6
SCHEMBL9678878 0.78 PPARG (0.40) ACEMETAP2POLBCYP1A2CYP3A4
SCHEMBL9906029 0.78 ACE (0.46) ACEMETAP2CYP1A2CYP3A4CYP2D6
SCHEMBL24939916 0.77 RIPK1 (0.40) ACEMETAP2CYP1A2CYP3A4CYP2D6
SCHEMBL6991605 0.75 CYP2C19 (0.51) ACEMETAP2CYP2C19
SCHEMBL9217462 0.75 ACE (0.44) ACEMETAP2CYP1A2CYP3A4CYP2D6

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
US-4536391-A REACTING A PLASMIN HEAVY CHAIN WITH UROKINASE IN THE PRESENCE OF A COUPLING AGENT OTSUKA PHARMACEUTICAL CO. (JP) 1985-08-20 US disclosed
EP-0109653-A2 Process for preparing urokinase complex OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-05-30 EP disclosed