SCHEMBL9101435

SCHEMBL9101435

CCN1C(=O)c2cccnc2Oc2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.60
MAPT P10636 3/20 0.54
LMNA P02545 3/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KMT2A Q03164 2/20 0.49
THRB P10828 3/20 0.49
POLB P06746 4/20 0.48
CDK8 P49336 1/20 0.47
GAA P10253 1/20 0.46
MEN1 O00255 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
SCHEMBL9212981 0.90 TP53 (0.58) TP53MAPTLMNASMN1; SMN2KMT2A
SCHEMBL9099785 0.87 TP53 (0.56) TP53MAPTLMNASMN1; SMN2KMT2A
SCHEMBL9099840 0.85 MAPT (0.58) MAPTLMNASMN1; SMN2KMT2ATHRB
SCHEMBL9101209 0.83 TP53 (0.54) TP53MAPTLMNASMN1; SMN2KMT2A
SCHEMBL9102280 0.82 TP53 (0.52) TP53MAPTLMNASMN1; SMN2KMT2A
SCHEMBL8401275 0.81 HDAC3 (0.53) TP53MAPTLMNASMN1; SMN2KMT2A
SCHEMBL9098669 0.81 MAPT (0.46) TP53MAPTLMNASMN1; SMN2KMT2A
SCHEMBL9098233 0.80 TP53 (0.53) TP53MAPTKMT2ATHRBPOLB
SCHEMBL12142337 0.78 TP53 (0.49) TP53MAPTLMNASMN1; SMN2KMT2A
SCHEMBL8936588 0.77 MAPT (0.50) MAPTLMNASMN1; SMN2KMT2ATHRB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5550122-A INHIBIT REVERSE TRANSCRIPTASE BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 1996-08-27 US disclosed
EP-0415303-B1 Pyrido [2,3-b][1,5]benzoxazepin (and thiazepin)-5(6H)-ones and -thiones and their use in the prevention or treatment of HIV infection BOEHRINGER INGELHEIM PHARMA (US) 1995-12-13 EP disclosed
EP-0415303-A2 Pyrido [2,3-b][1,5]benzoxazepin (and thiazepin)-5(6H)-ones and -thiones and their use in the prevention or treatment of HIV infection BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 1991-03-06 EP disclosed