SCHEMBL8906333

SCHEMBL8906333

CC([NH])C(=O)Nc1ccc(-c2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.70
RAB9A P51151 5/20 0.55
NPC1 O15118 4/20 0.55
POLB P06746 1/20 0.55
PTPN1 P18031 3/20 0.55
PTPN11 Q06124 2/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
ALDH1A1 P00352 3/20 0.54
MAPT P10636 2/20 0.54
RXFP1 Q9HBX9 1/20 0.54
SMN1; SMN2 Q16637 4/20 0.51
HTT P42858 2/20 0.51
HPGD P15428 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
PSEN1 P49768 2/20 0.51
PSEN2 P49810 2/20 0.51
APH1B Q8WW43 2/20 0.51
NCSTN Q92542 2/20 0.51
APH1A Q96BI3 2/20 0.51

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
SCHEMBL7167547 0.85 TAAR1 (0.74) TAAR1RAB9ANPC1POLBPTPN1
SCHEMBL224150 0.82 TAAR1 (0.70) TAAR1RAB9ANPC1POLBPTPN1
SCHEMBL1751436 0.82 TAAR1 (1.00) TAAR1RAB9ANPC1POLBPTPN1
SCHEMBL18638548 0.82 TAAR1 (0.70) TAAR1RAB9ANPC1POLBPTPN1
SCHEMBL4652086 0.82 TAAR1 (1.00) TAAR1RAB9ANPC1POLBPTPN1
SCHEMBL24879174 0.82 TAAR1 (0.70) TAAR1RAB9ANPC1POLBPTPN1
SCHEMBL4651929 0.79 TAAR1 (0.76) TAAR1RAB9ANPC1POLBPTPN1
SCHEMBL12310233 0.79 TAAR1 (0.66) TAAR1RAB9ANPC1POLBPTPN1
SCHEMBL17626174 0.79 TAAR1 (0.66) TAAR1RAB9ANPC1POLBPTPN1
SCHEMBL1750312 0.79 TAAR1 (0.76) TAAR1RAB9ANPC1POLBPTPN1

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-5684029-A HYPOTENSIVE AGENTS KARL THOMAE GMBH (DE) 1997-11-04 US disclosed
US-5587393-A ANGIOTENSIN ANTAGONIST USEFUL IN TREATING HYPERTENSION DR. KARL THOMAE GMBH (DE) 1996-12-24 US disclosed
US-5385925-A Benzimidazoles, pharmaceutical compositions containing these compounds and processes for preparing them DR. KARL THOMAE GMBH (DE) 1995-01-31 US disclosed