SCHEMBL7283286

SCHEMBL7283286

C=Cc1c(-c2ccccn2)cn[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 13/20 0.47
MAPK14 Q16539 3/20 0.44
TGFBR2 P37173 1/20 0.41
ABL2 P42684 1/20 0.41
CSNK1A1 P48729 1/20 0.41
CSNK1D P48730 1/20 0.41
MAP3K20 Q9NYL2 1/20 0.41
CHEK1 O14757 1/20 0.40
BTK Q06187 1/20 0.40
METAP2 P50579 1/20 0.38
KDM4E B2RXH2 2/20 0.37
LMNA P02545 2/20 0.37
POLB P06746 2/20 0.37
CYP1A2 P05177 1/20 0.37
CCR1 P32246 1/20 0.37
CCR5 P51681 1/20 0.37
CCR8 P51685 1/20 0.37
METAP1 P53582 1/20 0.37
BLM P54132 1/20 0.37
HIF1A Q16665 1/20 0.37

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
SCHEMBL7264282 0.75 TGFBR1 (0.59) TGFBR1MAPK14TGFBR2ABL2CSNK1A1
SCHEMBL3753128 0.73 PRKCI (0.47) TGFBR1MAPK14TGFBR2ABL2CSNK1A1
SCHEMBL10413171 0.71 TGFBR1 (0.77) TGFBR1MAPK14TGFBR2ABL2CSNK1A1
SCHEMBL16556061 0.71 TGFBR1 (0.53) TGFBR1MAPK14TGFBR2ABL2CSNK1A1
SCHEMBL15314119 0.69 AKT1 (0.56) TGFBR1MAPK14TGFBR2ABL2CSNK1A1
SCHEMBL4510667 0.69 LMNA (0.56) TGFBR1MAPK14TGFBR2ABL2CSNK1A1
SCHEMBL12313143 0.69 TGFBR1 (0.51) TGFBR1MAPK14TGFBR2ABL2CSNK1A1
SCHEMBL398499 0.69 KDM4E (0.50) TGFBR1KDM4ELMNAPOLBCYP1A2
SCHEMBL23294714 0.68 TGFBR1 (0.54) TGFBR1MAPK14TGFBR2ABL2CSNK1A1
SCHEMBL29852117 0.68 TGFBR1 (0.54) TGFBR1MAPK14TGFBR2ABL2CSNK1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4656170-A CARDIOTONIC, HYPOTENSIVE, ANTITHROMBOTIC WARNER-LAMBERT COMPANY (US) 1987-04-07 US disclosed
US-4599332-A CARDIOTONIC, HYPOTENSIVE WARNER-LAMBERT COMPANY (US) 1986-07-08 US disclosed
EP-0081906-B1 PHARMACEUTICALLY-ACTIVE PYRIDYLVINYLPYRIDAZINONES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-07-24 EP disclosed
EP-0081906-B1 PHARMACEUTICALLY-ACTIVE PYRIDYLVINYLPYRIDAZINONES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-07-24 EP disclosed
EP-0145450-A2 6- [2-[4-(1H-imidazol-1-yl)phenyl]-alkylene and alkylenyl]-3(2H)-pyridazinones, the 4,5-dihydro- pyridazinone derivatives thereof, and a process for the preparation thereof WARNER-LAMBERT COMPANY (US) 1985-06-19 EP disclosed
US-4508721-A Pyridazin-3-one derivatives IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1985-04-02 US disclosed
EP-0081906-A1 Pharmaceutically-active pyridylvinylpyridazinones IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-06-22 EP disclosed
EP-0081906-A1 Pharmaceutically-active pyridylvinylpyridazinones IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-06-22 EP disclosed