SCHEMBL8392178

SCHEMBL8392178

CCON(C([NH])=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
TSHR P16473 3/20 0.44
GLA P06280 1/20 0.44
TP53 P04637 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
KMT2A Q03164 5/20 0.40
NPC1 O15118 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
RAB9A P51151 2/20 0.40
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
MEN1 O00255 4/20 0.39
PIN1 Q13526 1/20 0.39
LMNA P02545 1/20 0.39
JAK2 O60674 1/20 0.37
PAX8 Q06710 1/20 0.37
CYP1A2 P05177 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL10442749 0.86 LMNA (0.43) ALDH1A1TSHRGLATP53SMN1; SMN2
SCHEMBL25336401 0.85 ALDH1A1 (0.47) ALDH1A1TSHRGLATP53SMN1; SMN2
SCHEMBL5512049 0.85 ALDH1A1 (0.47) ALDH1A1TSHRGLATP53SMN1; SMN2
SCHEMBL5932403 0.83 ALDH1A1 (0.46) ALDH1A1TSHRGLATP53SMN1; SMN2
SCHEMBL13603966 0.83 ALDH1A1 (0.46) ALDH1A1TSHRGLATP53SMN1; SMN2
SCHEMBL8395345 0.83 TSHR (0.44) ALDH1A1TSHRGLATP53KMT2A
SCHEMBL8395773 0.81 ALDH1A1 (0.39) ALDH1A1TSHRGLATP53SMN1; SMN2
SCHEMBL5932823 0.81 ALDH1A1 (0.44) ALDH1A1TSHRGLATP53SMN1; SMN2
SCHEMBL5932829 0.81 ALDH1A1 (0.44) ALDH1A1TSHRGLATP53SMN1; SMN2
SCHEMBL13603962 0.81 TP53 (0.61) ALDH1A1TSHRGLATP53SMN1; SMN2

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
US-5864043-A CARDIOVASCULAR DISORDERS AND ANGIOTENSIN ANTAGONIST KARL THOMAE GMBH (DE) 1999-01-26 US disclosed
US-5541229-A ANGIOITENSIN II ANTAGONIST AS HYPOTENSIVE AGENTS, ANTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1996-07-30 US disclosed
EP-0392317-B1 Benzimidazoles, drugs containing these compounds and process for their preparation THOMAE GMBH DR K (DE) 1996-01-03 EP disclosed
EP-0392317-A2 Benzimidazoles, drugs containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1990-10-17 EP disclosed