SCHEMBL18977121

SCHEMBL18977121

c1ccc(-c2ccc(C3NCNc4ccccc43)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRCP P42785 4/20 0.39
KDM1A O60341 3/20 0.38
MAOB P27338 1/20 0.38
GAA P10253 2/20 0.38
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
NPC1 O15118 2/20 0.37
KDM4E B2RXH2 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
LMNA P02545 1/20 0.36
RECQL P46063 1/20 0.35
GID4 Q8IVV7 3/20 0.34
RAB9A P51151 1/20 0.33

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
SCHEMBL18977551 0.89 PRCP (0.47) PRCPKDM1AGAAMEN1MAPT
SCHEMBL15506389 0.75 KDM1A (0.40) PRCPKDM1AMAOBGAAMEN1
SCHEMBL5598091 0.73 PRCP (0.55) PRCPKDM1AGAAMEN1MAPT
SCHEMBL193241 0.71 RECQL (0.41) PRCPGAAMEN1MAPTKMT2A
SCHEMBL5255355 0.68 CHRNB4 (0.30) GAAMEN1MAPTKMT2ALMNA
SCHEMBL6076273 0.68 ALDH1A1 (0.33) MAOBGAAMEN1MAPTKMT2A
SCHEMBL7423130 0.68 HTR2A (0.34) KDM1AMEN1MAPTKMT2ALMNA
Hydrochloric Acid SCHEMBL4630224 0.67 TSHR (0.32) GAA
SCHEMBL20594416 0.67 TSHR (0.50) GAAMAPT
SCHEMBL1563035 0.66 PRCP (0.46) PRCPKDM1AMAOBGAAMEN1

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
WO-2017099516-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-06-15 WO disclosed