SCHEMBL8618150

SCHEMBL8618150

Cc1ccc(-c2cc(NC(=N)NC=O)c3ccccc3n2)cc1C

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 3/20 0.48
TP53 P04637 4/20 0.47
MAPT P10636 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
HTT P42858 3/20 0.45
LMNA P02545 2/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
RECQL P46063 1/20 0.44
POLB P06746 2/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PDE10A Q9Y233 1/20 0.43
ACP1 P24666 1/20 0.43

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
SCHEMBL8615355 0.89 PDE10A (0.55) KDM4EALDH1A1HPGDMAPTMEN1
SCHEMBL8617753 0.87 ACP1 (0.51) KDM4ESMN1; SMN2LMNAMEN1KMT2A
SCHEMBL8618948 0.87 MEN1 (0.50) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL8618939 0.86 ACP1 (0.44) KDM4EHTTMEN1KMT2APDE10A
SCHEMBL8619784 0.86 ACP1 (0.44) KDM4EMEN1KMT2APDE10AACP1
SCHEMBL8620932 0.85 POLB (0.51) KDM4EPOLBMEN1KMT2APDE10A
SCHEMBL8620892 0.84 HTT (0.47) KDM4EALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL8615877 0.84 PTGER4 (0.41) KDM4EALDH1A1HPGDSMN1; SMN2HTT
SCHEMBL8615248 0.84 ACP1 (0.44) KDM4EKMT2APDE10AACP1
SCHEMBL8617549 0.84 ACP1 (0.49) KDM4ETP53MAPTLMNAMEN1

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
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