SCHEMBL454709

SCHEMBL454709

CCn1c(-c2cccnc2)ncc(C(=O)Oc2ccccc2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
LMNA P02545 4/20 0.44
KMT2A Q03164 5/20 0.43
MEN1 O00255 2/20 0.43
POLB P06746 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CCNC P24863 1/20 0.42
CDK8 P49336 1/20 0.42
MAPT P10636 3/20 0.42
CYP2C19 P33261 3/20 0.41
CYP2C9 P11712 2/20 0.41
CYP1A2 P05177 2/20 0.41
TSHR P16473 1/20 0.41
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP2E1 P05181 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2A6 P11509 1/20 0.41
CYP2B6 P20813 1/20 0.41

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
SCHEMBL11768659 0.76 KDM4E (0.50) ALDH1A1LMNAPOLBNPC1RAB9A
SCHEMBL456136 0.75 MAPT (0.52) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL9893973 0.75 NPC1 (0.59) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL6558390 0.74 NPC1 (0.46) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL7292972 0.74 GABRA1 (0.43) ALDH1A1KMT2AMEN1MAPTKDM4E
SCHEMBL6558315 0.73 MEN1 (0.42) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL7960592 0.72 SMN1; SMN2 (0.60) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL462890 0.72 KDM4E (0.41) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL462187 0.72 ALDH1A1 (0.46) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL9894331 0.69 MAPT (0.56) ALDH1A1LMNAKMT2AMEN1POLB

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-3436461-A1 PYRROLOTRIAZINE COMPOUNDS AS TAM INHIBITORS Incyte Corporation (US) 2019-02-06 EP disclosed
WO-2017172596-A1 PYRROLOTRIAZINE COMPOUNDS AS TAM INHIBITORS INCYTE CORPORATION (US) 2017-10-05 WO disclosed
EP-2475654-A1 HERBICIDAL PYRIMIDONE DERIVATIVES E. I. du Pont de Nemours and Company (US) 2012-07-18 EP disclosed
WO-2012033548-A2 HERBICIDAL BIS-NITROGEN-CONTAINING OXO AND SULFONO HETEROCYCLES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-03-15 WO disclosed
WO-2011031658-A1 HERBICIDAL PYRIMIDONE DERIVATIVES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-03-17 WO disclosed