SCHEMBL8613320

SCHEMBL8613320

O=C(O)c1cccnc1NC(=O)c1cc(Cl)cc(Cl)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 6/20 0.52
KMT2A Q03164 6/20 0.52
MEN1 O00255 5/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
RAB9A P51151 3/20 0.52
CLCN2 P51788 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.46
ACLY P53396 1/20 0.46
MAPT P10636 4/20 0.45
PLEC Q15149 1/20 0.45
SORT1 Q99523 1/20 0.45
LMNA P02545 3/20 0.45
GAA P10253 2/20 0.44
ALDH1A1 P00352 1/20 0.44
NPC1 O15118 2/20 0.43
PPARG P37231 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL18640822 0.82 GRM4 (0.58) DHODHKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL8798613 0.78 DHODH (0.54) DHODHKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL8610236 0.78 ALDH1A1 (0.58) DHODHKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL18640754 0.78 RAB9A (0.65) DHODHKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL1307643 0.77 MEN1 (0.63) DHODHKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL1307493 0.77 DHODH (0.56) DHODHKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL27474432 0.77 KCNMA1 (0.67) KMT2AMEN1SMN1; SMN2RAB9AL3MBTL1
SCHEMBL23796859 0.76 DHODH (0.53) DHODHKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL7553677 0.76 DHODH (0.56) DHODHKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL4193561 0.75 DHODH (0.51) DHODHKMT2AMEN1SMN1; SMN2RAB9A

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-5849735-A Tricyclic benzazepine vasopressin antagonists AMERICAN CYANAMID COMPANY (US) 1998-12-15 US disclosed