SCHEMBL7783116

SCHEMBL7783116

O=CNCc1ccc(Cl)nc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.54
GAA P10253 2/20 0.54
MAPT P10636 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ADH1B P00325 1/20 0.47
ADH1C P00326 1/20 0.47
ADH1A P07327 1/20 0.47
ADH7 P40394 1/20 0.47
OXTR P30559 1/20 0.47
AVPR1A P37288 1/20 0.47
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KDM1A O60341 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
FAAH O00519 1/20 0.43
PKM P14618 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
SCHEMBL9279836 0.82 GAA (0.63) KDM4EGAAMAPTL3MBTL1OXTR
SCHEMBL888506 0.81 GAA (0.54) KDM4EGAAMAPTL3MBTL1OXTR
SCHEMBL4854048 0.79 KDM4E (0.51) KDM4EGAAMAPTL3MBTL1OXTR
SCHEMBL4854061 0.79 KDM4E (0.51) KDM4EGAAMAPTL3MBTL1OXTR
SCHEMBL245979 0.76 ALDH1A1 (0.49) KDM4EGAAMAPTL3MBTL1ALDH1A1
SCHEMBL12674819 0.76 KDM4E (0.57) KDM4EGAAMAPTL3MBTL1OXTR
SCHEMBL14044150 0.76 GAA (0.56) KDM4EGAAMAPTL3MBTL1OXTR
SCHEMBL888411 0.76 KDM4E (0.56) KDM4EGAAMAPTL3MBTL1OXTR
SCHEMBL5266363 0.76 ALDH1A1 (0.45) KDM4EGAAMAPTL3MBTL1ALDH1A1
SCHEMBL7782632 0.75 KDM4E (0.51) KDM4EGAAMAPTL3MBTL1OXTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0556684-B1 Process for the preparation of 2-chloro-5-alkylamino-methylpyridines BAYER AG (DE) 1996-05-22 EP claimed
US-5382671-A Process for the preparation of 2-chloro-5-alkylaminomethyl-pyridines BAYER AKTIENGESELLSCHAFT (DE) 1995-01-17 US claimed
EP-0556684-A1 Process for the preparation of 2-chloro-5-alkylamino-methylpyridines BAYER AG (DE) 1993-08-25 EP claimed
EP-0691331-B1 Process for the preparation of n-acylated 2-chloro-5-aminomethyl-pyridines BAYER AG (DE) 2001-10-10 EP disclosed
CN-1042934-C Process for preparing 2-chloro-5-alkylaminomethylpyridines BAYER AG (DE) 1999-04-14 CN disclosed
US-5580983-A Process for the preparation of N-acylated 2-chloro-5-aminomethylpyridines BAYER AKTIENGESELLSCHAFT (DE) 1996-12-03 US disclosed
EP-0556684-B1 Process for the preparation of 2-chloro-5-alkylamino-methylpyridines BAYER AG (DE) 1996-05-22 EP disclosed
EP-0691331-A1 Process for the preparation of n-acylated 2-chloro-5-aminomethyl-pyridines BAYER AG (DE) 1996-01-10 EP disclosed
US-5382671-A Process for the preparation of 2-chloro-5-alkylaminomethyl-pyridines BAYER AKTIENGESELLSCHAFT (DE) 1995-01-17 US disclosed
US-5382671-A Process for the preparation of 2-chloro-5-alkylaminomethyl-pyridines BAYER AKTIENGESELLSCHAFT (DE) 1995-01-17 US disclosed
EP-0556684-A1 Process for the preparation of 2-chloro-5-alkylamino-methylpyridines BAYER AG (DE) 1993-08-25 EP disclosed
EP-0556684-A1 Process for the preparation of 2-chloro-5-alkylamino-methylpyridines BAYER AG (DE) 1993-08-25 EP disclosed