SCHEMBL21074236

SCHEMBL21074236

Cc1cccc(C)c1N1c2ccccc2N(c2c(C)ccc3c2oc2ccccc23)C1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
CYP2C19 P33261 1/20 0.37
PGR P06401 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.33
LMNA P02545 4/20 0.33
TP53 P04637 2/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 3/20 0.33
HPGD P15428 1/20 0.33
ALOX5 P09917 3/20 0.33
ALDH1A1 P00352 6/20 0.32
NPSR1 Q6W5P4 2/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
NPY1R P25929 1/20 0.32
HTT P42858 1/20 0.32
NPY2R P49146 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RXFP1 Q9HBX9 2/20 0.32

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
SCHEMBL19999694 1.00 MEN1 (0.37) MEN1KMT2ACYP2C19PGRSMN1; SMN2
SCHEMBL21074253 0.90 MEN1 (0.33) MEN1KMT2ACYP2C19PGRSMN1; SMN2
SCHEMBL20349236 0.90 MEN1 (0.33) MEN1KMT2ACYP2C19PGRSMN1; SMN2
SCHEMBL19999702 0.90 MEN1 (0.33) MEN1KMT2ACYP2C19PGRSMN1; SMN2
SCHEMBL22025367 0.89 MEN1 (0.34) MEN1KMT2ACYP2C19PGRLMNA
SCHEMBL21074292 0.89 TSHR (0.34) MEN1KMT2ACYP2C19PGRSMN1; SMN2
SCHEMBL19999707 0.89 TSHR (0.34) MEN1KMT2ACYP2C19PGRSMN1; SMN2
SCHEMBL16716134 0.88 MEN1 (0.34) MEN1KMT2ACYP2C19PGRSMN1; SMN2
SCHEMBL13843646 0.88 MEN1 (0.34) MEN1KMT2ACYP2C19PGRSMN1; SMN2
SCHEMBL17655183 0.88 MEN1 (0.34) MEN1KMT2ACYP2C19PGRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3492480-B1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2021-10-20 EP disclosed
EP-3492480-A2 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2019-06-05 EP disclosed