SCHEMBL8906338

SCHEMBL8906338

CCN(C(=O)NC)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
ALDH1A1 P00352 4/20 0.53
TSHR P16473 2/20 0.53
GLA P06280 1/20 0.53
MAPT P10636 3/20 0.47
HPGD P15428 2/20 0.47
ROCK2 O75116 3/20 0.47
KDM4E B2RXH2 1/20 0.45
AGTR1 P30556 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TP53 P04637 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
NOX1 Q9Y5S8 1/20 0.41

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
SCHEMBL966694 0.90 MEN1 (0.69) MEN1KMT2AALDH1A1TSHRGLA
SCHEMBL27654625 0.82 ALDH1A1 (0.60) MEN1KMT2AALDH1A1TSHRGLA
SCHEMBL11262493 0.81 ALDH1A1 (0.58) MEN1KMT2AALDH1A1TSHRGLA
Hydrochloric Acid SCHEMBL3998159 0.79 ALDH1A1 (0.51) MEN1KMT2AALDH1A1TSHRGLA
SCHEMBL8905438 0.77 ROCK2 (0.60) ALDH1A1MAPTROCK2KDM4EHDAC6
SCHEMBL9260027 0.77 PTGES (0.48) MEN1KMT2AALDH1A1ROCK2
SCHEMBL8791607 0.77 ALDH1A1 (0.53) MEN1KMT2AALDH1A1TSHRGLA
SCHEMBL11546145 0.76 MAPT (0.41) ALDH1A1MAPTHPGDROCK2KDM4E
SCHEMBL9340745 0.76 TP53 (0.54) MEN1KMT2AALDH1A1TSHRGLA
SCHEMBL11176470 0.75 ALDH1A1 (0.66) MEN1KMT2AALDH1A1TSHRGLA

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