SCHEMBL9514737

SCHEMBL9514737

CNC(=O)c1cc2cc(OC)ccc2n1C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.76
KDM4E B2RXH2 3/20 0.71
ALDH1A1 P00352 3/20 0.71
HPGD P15428 3/20 0.71
HSD17B10 Q99714 2/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
MAPT P10636 4/20 0.59
TP53 P04637 2/20 0.57
POLB P06746 2/20 0.56
GALR3 O60755 1/20 0.55
GAA P10253 1/20 0.55
LMNA P02545 2/20 0.54
ATM Q13315 1/20 0.52
HDAC3 O15379 1/20 0.50
HDAC1 Q13547 1/20 0.50
MEN1 O00255 1/20 0.49
BLM P54132 1/20 0.49
KMT2A Q03164 1/20 0.49
THRB P10828 1/20 0.48
GFER P55789 1/20 0.47

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
SCHEMBL2277189 0.88 L3MBTL1 (0.58) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL5426590 0.86 L3MBTL1 (1.00) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL28135680 0.84 KDM4E (0.60) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4369004 0.83 KDM4E (1.00) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10085396 0.83 KDM4E (0.77) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL9410563 0.82 SMN1; SMN2 (0.67) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4502502 0.82 KDM4E (0.75) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL8687313 0.81 L3MBTL1 (0.65) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL12883756 0.79 KDM4E (0.71) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL2730305 0.79 KDM4E (0.71) L3MBTL1KDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0382533-B1 INDOLE DERIVATES CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 1993-01-27 EP disclosed
US-5130327-A Antidepressants CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 1992-07-14 US disclosed
WO-1990009375-A1 INDOLE DERIVATIVES CONSEJO SUPERIOR INVESTIGACIONES CIENTIFICAS (ES) 1990-08-23 WO disclosed
EP-0382533-A1 Indole derivates CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 1990-08-16 EP disclosed