SCHEMBL7940984

SCHEMBL7940984

CN(C)CCn1cc(C(=O)NCc2ccc(Cl)cc2)c(=O)c2cc(C#CCO)ccc21

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
RECQL P46063 1/20 0.51
MAPT P10636 1/20 0.49
F2 P00734 1/20 0.47
ATM Q13315 1/20 0.46

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
Hydrochloric Acid SCHEMBL6699579 0.99 MEN1 (0.54) MEN1KMT2ALMNAGAARECQL
SCHEMBL6700352 0.95 MEN1 (0.53) MEN1KMT2ALMNAGAARECQL
SCHEMBL6702174 0.92 MEN1 (0.54) MEN1KMT2ALMNAGAARECQL
SCHEMBL6667425 0.91 MEN1 (0.53) MEN1KMT2ALMNAGAARECQL
SCHEMBL6666937 0.91 MEN1 (0.55) MEN1KMT2ALMNAGAARECQL
SCHEMBL6702706 0.90 MEN1 (0.52) MEN1KMT2ALMNAGAARECQL
SCHEMBL6668589 0.87 MAPT (0.61) MEN1KMT2AMAPT
SCHEMBL6698530 0.86 MEN1 (0.51) MEN1KMT2ALMNAGAARECQL
SCHEMBL6696045 0.86 MEN1 (0.51) MEN1KMT2ALMNAGAARECQL
SCHEMBL6697650 0.86 MEN1 (0.49) MEN1KMT2ALMNAGAARECQL

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-6248739-B1 DNA POLYMERASE INHIBITORS EFFECTIVE AGAINST HERPESVIRUSES PHARMACIA & UPJOHN COMPANY 2001-06-19 US disclosed