SCHEMBL9750459

SCHEMBL9750459

NC(=O)NSC(N)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.44
LMNA P02545 1/20 0.42
CTSD P07339 1/20 0.41
GAA P10253 1/20 0.40
CYP2D6 P10635 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SRC P12931 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38

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
SCHEMBL27726737 0.82 LMNA (0.47) BCAT2LMNACTSDGAACYP2D6
SCHEMBL28027566 0.81 LMNA (0.46) BCAT2LMNACTSDGAACYP2D6
SCHEMBL27540557 0.79 LMNA (0.45) BCAT2LMNACTSDGAAHSD17B10
SCHEMBL11266650 0.75 BCAT2 (0.40) BCAT2LMNACTSDGAACYP2D6
SCHEMBL27480645 0.74 MEN1 (0.44) BCAT2LMNACTSDCYP2D6CYP1A2
SCHEMBL28134112 0.74 BCAT2 (0.42) BCAT2LMNACTSDGAACYP2D6
Hydrochloric Acid SCHEMBL27460407 0.68 LMNA (0.53) BCAT2LMNACTSDGAACYP2D6
SCHEMBL28389887 0.68 DPP4 (0.50) LMNAALDH1A1DPP4F2
SCHEMBL1386996 0.67 LMNA (0.79) BCAT2LMNACTSDGAATSHR
SCHEMBL14889780 0.67 LMNA (0.56) BCAT2LMNACTSDGAACYP2D6

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-0217577-B1 ANTIBODY COMPLEXES OF HAPTEN-MODIFIED DIAGNOSTIC OR THERAPEUTIC AGENTS HYBRITECH INCORPORATED (US) 1992-06-10 EP claimed