SCHEMBL11160504

SCHEMBL11160504

C=CCNc1nc(-c2ccccc2)ncc1C#N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ ALDH1A1 P00352 4/20 0.50
▸ LMNA P02545 3/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.50
▸ HPGD P15428 3/20 0.50
▸ HIF1A Q16665 3/20 0.50
▸ HTT P42858 2/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ MAPT P10636 3/20 0.41
▸ KLK7 P49862 1/20 0.41
▸ ADORA2A P29274 1/20 0.40
▸ ADORA1 P30542 1/20 0.40
▸ GAA P10253 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ GLA P06280 1/20 0.39

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
SCHEMBL11160250 0.77 MAPT (0.47) KDM4EALDH1A1LMNAL3MBTL1HPGD
SCHEMBL7507341 0.77 PDE10A (0.48) KDM4EALDH1A1LMNAL3MBTL1HPGD
SCHEMBL11162923 0.76 MEN1 (0.48) KDM4ESMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL11412801 0.75 HPGD (0.46) KDM4ESMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL4098956 0.72 ADORA2A (0.49) KDM4ESMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL11403379 0.71 L3MBTL1 (0.54) KDM4ESMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL11162029 0.71 ALDH1A1 (0.63) KDM4ESMN1; SMN2ALDH1A1LMNAL3MBTL1
SCHEMBL2878048 0.71 ADORA1 (0.44) KDM4ESMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL4864986 0.71 PDE5A (0.64) KDM4ESMN1; SMN2ALDH1A1LMNAHIF1A
SCHEMBL11203920 0.70 ADORA2A (0.68) KDM4EALDH1A1LMNAHTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0018139-B1 PYRIDO (2,3-D) PYRIMIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR PREPARING THE PYRIDO (2,3-D) PYRIMIDINE DERIVATIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1983-05-04 — — EP disclosed
US-4301281-A 7,8-Dihydro-2,5,8-trisubstituted-7-oxo-pyrido[2,3-d]-pyrimidine-6-carboxylic acid amides AMERICAN HOME PRODUCTS CORPORATION (US) 1981-11-17 — — US disclosed
US-4255568-A ANTIALLERGENS AND ANTISECRETORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1981-03-10 — — US disclosed
US-4236004-A 2-Alkylsulphonyl-7,8-dihydro-5-hydroxy-7-oxo-pyrido[2,3-d]pyrimidine-6-carboxylic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1980-11-25 — — US disclosed
US-4233446-A 5-Chloro-7,8-dihydro-7-oxo-pyrido[2,3-d]pyrimidine-6-carboxylic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1980-11-11 — — US disclosed
EP-0018139-A2 Pyrido (2,3-d) pyrimidine derivatives, pharmaceutical compositions containing them and processes for preparing the pyrido (2,3-d) pyrimidine derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1980-10-29 — — EP disclosed
US-4215216-A 7,8-Dihydro-2,5,8-trisubstituted-7-oxo-pyrido[2,3-d]pyrimidine-6-carboxylic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1980-07-29 — — US disclosed
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