SCHEMBL8613202

SCHEMBL8613202

O=C(O)c1cc(-c2ccccc2)nc2cccc(Cl)c12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.63
LMNA P02545 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
PDE10A Q9Y233 1/20 0.63
DHODH Q02127 7/20 0.60
AKR1C3 P42330 1/20 0.55
AKR1C2 P52895 1/20 0.55
AKR1C1 Q04828 1/20 0.55
POLB P06746 1/20 0.54
HSD17B10 Q99714 2/20 0.52
ALDH1A1 P00352 1/20 0.52
TP53 P04637 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C19 P33261 1/20 0.52
HIF1A Q16665 1/20 0.52
PPARA Q07869 1/20 0.51
MEN1 O00255 1/20 0.50
GFER P55789 1/20 0.50
KMT2A Q03164 1/20 0.50
CYP19A1 P11511 1/20 0.50

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
SCHEMBL22471917 0.85 KDM4E (0.59) KDM4ELMNASMN1; SMN2PDE10ADHODH
SCHEMBL4461409 0.82 KDM4E (0.63) KDM4ELMNASMN1; SMN2PDE10ADHODH
SCHEMBL11668642 0.81 ALDH1A1 (0.49) KDM4EDHODHPOLBHSD17B10ALDH1A1
SCHEMBL8616258 0.81 MEN1 (0.46) KDM4ELMNASMN1; SMN2PDE10ADHODH
SCHEMBL10611217 0.80 SMN1; SMN2 (0.46) KDM4ELMNASMN1; SMN2PDE10ADHODH
SCHEMBL11668909 0.80 ALDH1A1 (0.47) KDM4EDHODHHSD17B10ALDH1A1MEN1
SCHEMBL10758845 0.79 PDE10A (0.64) KDM4ELMNASMN1; SMN2PDE10ADHODH
Cinchophen SCHEMBL29376617 0.78 KDM4E (1.00) KDM4ELMNASMN1; SMN2PDE10ADHODH
Cinchophen SCHEMBL25519 0.78 KDM4E (1.00) KDM4ELMNASMN1; SMN2PDE10ADHODH
Cinchophen SCHEMBL7588217 0.78 KDM4E (1.00) KDM4ELMNASMN1; SMN2PDE10ADHODH

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-0726254-B1 Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds MITSUI TOATSU CHEMICALS (JP) 1998-05-06 EP disclosed
US-5627193-A MEDICAL DIAGNOSIS, CARDIOVASCULAR DIAORDERS AND PROTECTION OF ORGANS FOR TRANSPLANTATION MITSUI TOATSU CHEMICALS, INC. (JP) 1997-05-06 US disclosed
EP-0726254-A1 Quinoline-4-carbonylguanidine derivates, process for producing the same and pharmaceutical preparations containing the compounds MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-08-14 EP disclosed
US-4009020-A QUINOLINE-4-CARBOXYLIC ACID OR SALTS AMCHEM PRODUCTS, INC. (US) 1977-02-22 US disclosed