SCHEMBL10620370

SCHEMBL10620370

NCCCNc1ccc(O)c2c1C(=O)c1c(Cl)ccc(Cl)c1C2=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.62
MEN1 O00255 3/20 0.56
BLM P54132 3/20 0.56
KMT2A Q03164 3/20 0.56
USP2 O75604 2/20 0.56
LMNA P02545 2/20 0.56
TP53 P04637 2/20 0.56
MAPK1 P28482 2/20 0.56
RECQL P46063 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
CSNK2A2 P19784 2/20 0.56
CSNK2B P67870 2/20 0.56
CSNK2A1 P68400 2/20 0.56
CSNK2A3 Q8NEV1 2/20 0.56
NPC1 O15118 2/20 0.56
MTOR P42345 2/20 0.56
RAB9A P51151 2/20 0.56
NSD2 O96028 2/20 0.56
SLC22A2 O15244 1/20 0.56

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
SCHEMBL1323801 0.95 CYP19A1 (0.59) CYP19A1MEN1BLMKMT2AUSP2
SCHEMBL10624602 0.92 CYP19A1 (0.57) CYP19A1MEN1BLMKMT2AUSP2
SCHEMBL10524500 0.91 CYP19A1 (0.73) CYP19A1MEN1BLMKMT2AUSP2
Hydrochloric Acid SCHEMBL11150067 0.90 CYP19A1 (0.71) CYP19A1MEN1BLMKMT2AUSP2
SCHEMBL11279729 0.87 CYP19A1 (0.71) CYP19A1MEN1BLMKMT2AUSP2
SCHEMBL1323094 0.85 CYP19A1 (0.69) CYP19A1MEN1BLMKMT2AUSP2
SCHEMBL10619827 0.84 MEN1 (0.57) CYP19A1MEN1BLMKMT2AUSP2
SCHEMBL10523397 0.82 MEN1 (0.75) CYP19A1MEN1BLMKMT2AUSP2
SCHEMBL11517791 0.82 CYP19A1 (0.68) CYP19A1MEN1BLMKMT2AUSP2
SCHEMBL29350310 0.82 CYP19A1 (0.68) CYP19A1MEN1BLMKMT2AUSP2

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-4782092-A ANTITUMOR AGENTS, BACTERICIDES, FUNGICIDES MID-AMERICA CANCER CENTER (US) 1988-11-01 US disclosed