SCHEMBL7317752

SCHEMBL7317752

O=C1NCC(c2ccccc2)=NN1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.58
AXL P30530 1/20 0.56
SMN1; SMN2 Q16637 4/20 0.55
ALDH1A1 P00352 6/20 0.38
RAB9A P51151 4/20 0.38
HTT P42858 2/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 4/20 0.37
NPC1 O15118 3/20 0.37
KMT2A Q03164 2/20 0.37
PKM P14618 1/20 0.37
HPGD P15428 1/20 0.37
PDE3B Q13370 4/20 0.36
PDE3A Q14432 4/20 0.36
TYRO3 Q06418 1/20 0.35
NTRK2 Q16620 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
DYRK1B Q9Y463 1/20 0.35
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35

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
SCHEMBL4624669 0.81 GPR119 (0.46) GPR119AXLSMN1; SMN2ALDH1A1RAB9A
SCHEMBL9835352 0.81 GPR119 (0.46) GPR119AXLSMN1; SMN2ALDH1A1RAB9A
SCHEMBL7287880 0.81 GPR119 (0.46) GPR119AXLSMN1; SMN2ALDH1A1LMNA
SCHEMBL10804020 0.81 GPR119 (0.46) GPR119AXLSMN1; SMN2ALDH1A1RAB9A
SCHEMBL10783481 0.80 GPR119 (0.51) GPR119AXLSMN1; SMN2ALDH1A1KMT2A
SCHEMBL10783158 0.80 GPR119 (0.51) GPR119ALDH1A1HTTGAA
SCHEMBL10803096 0.80 GPR119 (0.51) GPR119SMN1; SMN2ALDH1A1RAB9ANPC1
SCHEMBL9670171 0.78 GPR119 (0.43) GPR119AXLSMN1; SMN2LMNAPDE3B
SCHEMBL10805730 0.78 PDE3B (0.43) GPR119AXLKMT2APDE3BPDE3A
SCHEMBL10804919 0.76 GPR119 (0.42) GPR119AXLSMN1; SMN2HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4788194-A CARDIOTONIC AGENTS, HYPOTENSIVE AGENTS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-11-29 US disclosed
US-4716164-A CARDIOTONIC, HYPOTENSIVE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-12-29 US disclosed
US-4694005-A CARDIOTONIC, HYPOTENSIVE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-09-15 US disclosed
US-4683232-A N,N-DIMETHYL-P-(2,3-DIHYDRO-2-OXO-6H-1,3,4 OXADIAZIN-2-YLBENZAMIDE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-07-28 US disclosed
US-4587246-A CARDIOTONIC IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-05-06 US disclosed
US-4584298-A CARDIOTONIC AGENTS, HYPOTENSIVE AGENTS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-04-22 US disclosed
US-4558045-A CARDIOTONIC AND HYPOTENSIVE ACTIVITY IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1985-12-10 US disclosed
EP-0052442-B1 HETEROCYCLIC COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-09-11 EP disclosed
US-4503054-A VASODILATORS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-03-05 US disclosed
US-4495185-A CARDIOTONIC AND/OR HYPOTENSIVE AGENTS IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1985-01-22 US disclosed
US-4493835-A CARDIOTONIC, HYPOTENSIVE AGENTS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-01-15 US disclosed
US-4489073-A HYPOTENSIVE AND CARDIOTONIC AGENTS IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1984-12-18 US disclosed
US-4489074-A CARDIOTONIC AGENTS, HYPOTENSIVE AGENTS IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1984-12-18 US disclosed
US-4423045-A CARDIOVASCULAR DISORDERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-12-27 US disclosed
EP-0086301-A1 Thiadiazine, oxadiazine and triazine derivatives and pharmaceutical compositions containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-08-24 EP disclosed
EP-0085227-A1 Thiadiazine derivatives, and pharmaceutical compositions containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-08-10 EP disclosed
EP-0080296-A1 Pharmaceutically active phenyl-thia-, oxa- or triazinones IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-06-01 EP disclosed
EP-0052442-A1 Heterocyclic compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-05-26 EP disclosed