SCHEMBL9101155

SCHEMBL9101155

CCN1C(=O)c2cccnc2Sc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.65
THRB P10828 2/20 0.63
TP53 P04637 3/20 0.59
MAPT P10636 3/20 0.59
POLB P06746 1/20 0.55
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
Bepiastine SCHEMBL1815039 0.84 LMNA (0.64) LMNATHRBTP53MAPTPOLB
Bepiastine SCHEMBL29560445 0.84 LMNA (0.64) LMNATHRBTP53MAPTPOLB
SCHEMBL9101431 0.82 LMNA (0.58) LMNATHRBTP53MAPTPOLB
SCHEMBL8791051 0.76 BRD4 (0.51) LMNATHRBTP53MAPTMEN1
SCHEMBL9369777 0.74 BRD4 (0.50) LMNATP53MAPTMEN1KMT2A
SCHEMBL8790081 0.73 ALDH1A1 (0.71) TP53MAPT
SCHEMBL9431569 0.73 ALDH1A1 (0.57)
SCHEMBL8301100 0.73 ALDH1A1 (0.50) LMNATHRBTP53MAPTMEN1
SCHEMBL8791127 0.72 BRD4 (0.48) LMNATHRBTP53MAPTMEN1
SCHEMBL9370046 0.72 BRD4 (0.48) LMNATP53MAPT

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