SCHEMBL8010306

SCHEMBL8010306

Cc1nc(-c2ccc(N)cc2)c[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.41
METAP2 P50579 1/20 0.41
MAPT P10636 6/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
ALDH1A1 P00352 5/20 0.40
HPGD P15428 3/20 0.40
TP53 P04637 5/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
ACHE P22303 2/20 0.39
KDM4E B2RXH2 3/20 0.39
CYP3A4 P08684 2/20 0.39
LMNA P02545 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
GLA P06280 1/20 0.39
PKM P14618 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GMNN O75496 1/20 0.38

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
SCHEMBL17983446 0.87 ENPP3 (0.36) METAP2MAPTMEN1KMT2AALDH1A1
SCHEMBL8250696 0.83 METAP2 (0.44) METAP2MAPTMEN1KMT2AALDH1A1
SCHEMBL17066733 0.82 ENPP3 (0.46) METAP2MAPTMEN1KMT2AALDH1A1
Ammonia Solution, Strong SCHEMBL28836149 0.82 KMT2A (0.43) METAP2MAPTMEN1KMT2AALDH1A1
SCHEMBL12616942 0.81 RAB9A (0.40) MAPTALDH1A1HPGDTP53SMN1; SMN2
SCHEMBL24484639 0.80 RAB9A (0.47) METAP2MAPTMEN1KMT2AALDH1A1
SCHEMBL13545715 0.80 PDGFRB (0.44) METAP2MAPTALDH1A1HPGDTP53
SCHEMBL15823275 0.80 RAD51 (0.43) ALDH1A1TP53SMN1; SMN2NPC1RAB9A
SCHEMBL28574508 0.80 MAPT (0.47) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL3669956 0.80 MEN1 (0.43) MAPTMEN1KMT2AALDH1A1HPGD

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
EP-0665468-B1 Staining inhibitor for photopolymerizable compositions containing a tetrazole MACDERMID IMAGING TECHNOLOGY (US) 2000-04-19 EP disclosed
US-6043254-A ANTIPROLIFERATIVE AGENT; ENZYME INHIBITOR BOEHRINGER INGELHEIM PHARMA KG (DE) 2000-03-28 US disclosed
EP-0131973-B1 NEW AMIDINE DERIVATIVES OF 2-SUBSTITUTED 4-PHENILIMIDAZOLE ISTITUTO DE ANGELI S.p.A. (IT) 1989-08-02 EP disclosed
US-4649150-A ANTISECRETORY AGENTS ISTITUTO DE ANGELI, S.P.A. (IT) 1987-03-10 US disclosed
EP-0131973-A1 New amidine derivatives of 2-substituted 4-phenilimidazole ISTITUTO DE ANGELI S.p.A. (IT) 1985-01-23 EP disclosed