SCHEMBL11765367

SCHEMBL11765367

CCNC(=O)N1CC(=O)Nc2ccc([N+](=O)[O-])cc2C1c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.63
KMT2A Q03164 9/20 0.63
ATM Q13315 2/20 0.54
HTT P42858 1/20 0.54
MAPT P10636 1/20 0.53
TP53 P04637 1/20 0.52
TACR1 P25103 1/20 0.52

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
SCHEMBL11764580 0.92 MEN1 (0.59) MEN1KMT2AATMHTTMAPT
SCHEMBL11152349 0.91 MEN1 (0.64) MEN1KMT2AATMHTTMAPT
SCHEMBL11759689 0.88 MEN1 (0.61) MEN1KMT2AATMHTTMAPT
SCHEMBL11762704 0.88 ATM (0.70) MEN1KMT2AATMHTTMAPT
SCHEMBL11762598 0.87 MEN1 (0.65) MEN1KMT2AATMHTTMAPT
SCHEMBL11154462 0.86 MEN1 (0.65) MEN1KMT2AATMHTTMAPT
SCHEMBL11767829 0.83 MEN1 (0.61) MEN1KMT2AATMHTTMAPT
SCHEMBL11762976 0.83 MEN1 (0.57) MEN1KMT2AATMHTTMAPT
SCHEMBL11762628 0.83 MEN1 (0.61) MEN1KMT2AATMHTTMAPT
SCHEMBL11762288 0.82 TP53 (0.71) MEN1KMT2AATMHTTMAPT

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-4045433-A SEDATIVES RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1977-08-30 US disclosed