SCHEMBL13905560

SCHEMBL13905560

CNC(=O)C(CS)NC(C)C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 1/20 0.42
▸ BMP1 P13497 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ THPO P40225 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MMP1 P03956 6/20 0.35
▸ MMP9 P14780 6/20 0.34
▸ MMP3 P08254 4/20 0.34
▸ MMP2 P08253 2/20 0.34
▸ MMP8 P22894 2/20 0.34
▸ ENPEP Q07075 3/20 0.32
▸ ANPEP P15144 1/20 0.31

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
SCHEMBL17450500 0.85 ACE (0.41) ACEBMP1KDM4EMAPTTHRB
SCHEMBL13169333 0.83 ACE (0.47) ACEBMP1KDM4EMAPTTHRB
SCHEMBL11111449 0.79 — —
SCHEMBL10084643 0.79 — —
SCHEMBL13163781 0.79 — —
SCHEMBL1058215 0.77 KDM4E (0.56) ACEKDM4EMAPTTHRBALOX15
SCHEMBL1058214 0.77 KDM4E (0.56) ACEKDM4EMAPTTHRBALOX15
SCHEMBL19729234 0.77 KDM4E (0.45) ACEKDM4EMAPTTHRBALOX15
SCHEMBL17524631 0.77 KDM4E (0.45) ACEKDM4EMAPTTHRBALOX15
SCHEMBL25761663 0.77 KDM4E (0.56) ACEKDM4EMAPTTHRBALOX15

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
WO-2009027844-A2 CRF CONJUGATES WITH EXTENDED HALF-LIVES CELTIC PHARMA MANAGEMENT L.P. (BM) 2009-03-05 — — WO disclosed
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