SCHEMBL8326089

SCHEMBL8326089

CCOC(=O)c1cnc2ccc(OCC)nc2c1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.52
▸ MEN1 O00255 4/20 0.52
▸ MAPT P10636 4/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ DYRK1A Q13627 4/20 0.45
▸ ALDH1A1 P00352 5/20 0.44
▸ MAPK1 P28482 3/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ LMNA P02545 3/20 0.44
▸ ATM Q13315 1/20 0.44
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ MAPK10 P53779 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ POLB P06746 1/20 0.42

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
SCHEMBL621738 0.91 KMT2A (0.51) KMT2AMEN1MAPTKDM4EGAA
SCHEMBL2280172 0.87 KMT2A (0.54) KMT2AMEN1MAPTKDM4EGAA
SCHEMBL15615933 0.87 KMT2A (0.54) KMT2AMEN1MAPTKDM4EGAA
SCHEMBL8327252 0.86 CYP1A2 (0.55) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL8327180 0.86 DYRK1A (0.45) KMT2AMEN1MAPTKDM4EDYRK1A
SCHEMBL8330280 0.85 KMT2A (0.52) KMT2AMEN1MAPTKDM4EGAA
SCHEMBL2802334 0.85 KMT2A (0.52) KMT2AMEN1MAPTKDM4EGAA
SCHEMBL4498553 0.81 KMT2A (0.49) KMT2AMEN1MAPTKDM4EDYRK1A
SCHEMBL8322999 0.80 KMT2A (0.58) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL9545028 0.79 KMT2A (0.54) KMT2AMEN1MAPTKDM4EALDH1A1

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-0705260-B1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AG (DE) 1999-03-03 — — EP disclosed
US-5780482-A TREATING RHEUMATIC DISEASES KNOLL AKTIENGESELLSCHAFT (DE) 1998-07-14 — — US disclosed
EP-0705260-A1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AKTIENGESELLSCHAFT (DE) 1996-04-10 — — EP disclosed
WO-1995000511-A1 CONDENSED 4-AMINOPYRIDINES WITH ANTIRHEUMATIC ACTIVITY KNOLL AG (DE) 1995-01-05 — — WO disclosed
Send feedback