SCHEMBL7280430

SCHEMBL7280430

N#Cc1cnc(-c2ccc(N)cc2)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.41
METAP2 P50579 1/20 0.39
KDM1A O60341 1/20 0.39
ALDH1A1 P00352 6/20 0.38
MAPT P10636 5/20 0.38
KDM4E B2RXH2 5/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
HPGD P15428 4/20 0.38
RAB9A P51151 3/20 0.38
TP53 P04637 2/20 0.38
NPC1 O15118 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PARP1 P09874 1/20 0.37
CYP3A4 P08684 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CTSC P53634 1/20 0.35
APP P05067 2/20 0.35
KEAP1 Q14145 1/20 0.35

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
SCHEMBL9020107 0.90 EGLN2 (0.46) EGLN2KDM1AALDH1A1MAPTKDM4E
SCHEMBL9159421 0.82 ALDH1A1 (0.53) METAP2ALDH1A1MAPTKDM4EMEN1
SCHEMBL7277326 0.81 MMP3 (0.44) EGLN2KDM1AALDH1A1MAPTMEN1
SCHEMBL4478958 0.81 MEN1 (0.43) EGLN2ALDH1A1MAPTKDM4EMEN1
SCHEMBL5235963 0.81 KDM4E (0.47) EGLN2ALDH1A1MAPTKDM4EMEN1
SCHEMBL7275344 0.79 KDM4E (0.53) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL9024387 0.77 KDM1A (0.49) EGLN2KDM1AALDH1A1KDM4EHPGD
SCHEMBL17502178 0.77 ALDH1A1 (0.50) EGLN2ALDH1A1MAPTKDM4EMEN1
SCHEMBL8975181 0.76 EGLN2 (0.38) EGLN2KDM1AALDH1A1KDM4EHPGD
SCHEMBL17539134 0.75 ALOX5AP (0.42) EGLN2KDM1AALDH1A1MAPTKDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650424-A ANTIAGGLOMERANTS USING IMIDAZOLIDINDIONES DR. KARL THOMAE GMBH (DE) 1997-07-22 US disclosed
EP-0503548-B1 Cyclic urea derivatives, medicaments contaning them and process for their preparation THOMAE GMBH DR K (DE) 1997-06-04 EP disclosed
US-5478942-A Antiinflammatory agents, antiagglomerants KARL THOMAE GMBH (DE) 1995-12-26 US disclosed
US-5276049-A Treatment of thrombosis DR. KARL THOMAE GMBH (DE) 1994-01-04 US disclosed
EP-0503548-A1 Cyclic urea derivatives, medicaments contaning them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-09-16 EP disclosed