SCHEMBL1443

SCHEMBL1443

C=CCOc1ccccc1C(=O)Nc1c(CCC)nn(C)c1C(N)=O

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.60
LIG1 P18858 1/20 0.47
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 4/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
NR1I2 O75469 1/20 0.38
AHR P35869 1/20 0.38
GAA P10253 1/20 0.37
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
ADRB3 P13945 1/20 0.37
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL30357138 0.89 TERT (0.65) TERTRAB9ANPC1LMNAMAPT
SCHEMBL1792 0.89 TERT (0.65) TERTRAB9ANPC1LMNAMAPT
SCHEMBL1669 0.88 TERT (0.64) TERTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL3670031 0.83 TERT (0.63) TERTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL8055429 0.82 TERT (0.56) TERTRAB9ANPC1LMNAMAPT
SCHEMBL8067045 0.79 TERT (0.52) TERTSMN1; SMN2LMNAMAPTNR1I2
SCHEMBL742 0.79 TERT (0.51) TERTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL988 0.77 MAPT (0.50) TERTRAB9ANPC1SMN1; SMN2LMNA
SCHEMBL13662765 0.76 TERT (0.48) TERTSMN1; SMN2LMNAMAPTNR1I2
SCHEMBL7960724 0.76 TERT (0.65) TERTRAB9ANPC1SMN1; SMN2MAPT

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-6200980-B1 ADMINISTERING PHENYL PURINONE COMPOUND FOR TREATING PRECANCEROUS LEISONS CELL PATHWAYS, INC. 2001-03-13 US disclosed
US-5719283-A INHIBITORS OF PHOSPHODIESTERASES; CARDIOVASCULAR DISORDERS PFIZER INC. (US) 1998-02-17 US disclosed
CN-1028758-C Pyrazolopyrimidinone antianginal agents PFIZER (US) 1995-06-07 CN disclosed
EP-0463756-B1 Pyrazolopyrimidinone antianginal agents PFIZER LTD (GB) 1995-04-19 EP disclosed
US-5346901-A Treatment of angina, hypertension, heart failure and atherosclerosis PFIZER INC. (US) 1994-09-13 US disclosed
US-5250534-A Inhibitors of cyclic guanosine 3*,5*-monophosphate phosphodiesterase PFIZER INC. (US) 1993-10-05 US disclosed
EP-0463756-A1 Pyrazolopyrimidinone antianginal agents Pfizer Limited (GB) 1992-01-02 EP disclosed
CN-1057464-A Pyrazolopyrimidinoneantianginal antianginal agents PFIZER (US) 1992-01-01 CN disclosed