SCHEMBL7846817

SCHEMBL7846817

O=C(CCc1c[nH]c2ccccc12)NCc1ccc(Cl)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.78
HPGD P15428 1/20 0.78
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
NPSR1 Q6W5P4 1/20 0.65
GFER P55789 1/20 0.65
POLB P06746 2/20 0.64
LMNA P02545 2/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
ALDH1A1 P00352 3/20 0.62
GAA P10253 1/20 0.62
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
SIRT1 Q96EB6 1/20 0.61
GABRP O00591 1/20 0.59
GABRD O14764 1/20 0.59
GABRA1 P14867 1/20 0.59
GABRB1 P18505 1/20 0.59
GABRG2 P18507 1/20 0.59
GABRB3 P28472 1/20 0.59

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
SCHEMBL7846928 0.90 GFER (0.80) MAPTHPGDMEN1KMT2AGFER
SCHEMBL7838803 0.90 LMNA (0.76) MAPTHPGDMEN1KMT2ANPSR1
SCHEMBL7853851 0.88 MAPT (0.66) MAPTHPGDMEN1KMT2ANPSR1
SCHEMBL8696236 0.88 LMNA (0.66) MAPTHPGDMEN1KMT2ANPSR1
SCHEMBL7850581 0.88 KMT2A (0.65) MAPTHPGDMEN1KMT2ANPSR1
SCHEMBL7851406 0.87 MEN1 (0.68) MAPTHPGDMEN1KMT2ANPSR1
SCHEMBL7844386 0.87 KMT2A (0.65) MAPTHPGDMEN1KMT2ANPSR1
SCHEMBL7855460 0.86 MEN1 (0.64) MAPTHPGDMEN1KMT2ANPSR1
SCHEMBL7847723 0.85 POLB (0.64) MAPTHPGDMEN1KMT2ANPSR1
SCHEMBL7853896 0.84 TRPV1 (0.65) MAPTHPGDMEN1KMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479235-A1 Indole compound-containing composition and light-emitting device using the composition Sumitomo Chemical Co., Ltd (JP) 2012-07-25 EP disclosed
US-20100073602-A1 INDOLE COMPOUND-CONTAINING COMPOSITION AND LIGHT-EMITTING DEVICE USING THE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-25 US disclosed
US-20100073602-A1 INDOLE COMPOUND-CONTAINING COMPOSITION AND LIGHT-EMITTING DEVICE USING THE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-25 US disclosed
EP-2119752-A1 INDOLE COMPOUND-CONTAINING COMPOSITION AND LIGHT-EMITTING DEVICE USING THE COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-11-18 EP disclosed
EP-1140914-A1 NON-PEPTIDE NK1 RECEPTORS ANTAGONISTS WARNER-LAMBERT COMPANY (US) 2001-10-10 EP disclosed
WO-2000037462-A1 NON-PEPTIDE NK1 RECEPTORS ANTAGONISTS WARNER-LAMBERT COMPANY (US) 2000-06-29 WO disclosed