SCHEMBL10569490

SCHEMBL10569490

Cc1cc(C)c(/N=c2/cc(-c3ccccc3)n(C)c(=O)n2C)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.46
TSHR P16473 2/20 0.46
MAPK1 P28482 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ABCC4 O15439 1/20 0.46
ABCC5 O15440 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
NFKB1 P19838 1/20 0.46
PDE4A P27815 1/20 0.46
CYP2C19 P33261 1/20 0.46
THPO P40225 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
HIF1A Q16665 1/20 0.46
KMT2A Q03164 5/20 0.45
MEN1 O00255 3/20 0.45

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
SCHEMBL10569498 1.00 CYP3A4 (0.46) CYP3A4TSHRMAPK1TDP1SMN1; SMN2
SCHEMBL10564768 0.84 MAPT (0.50) CYP3A4TSHRMAPK1TDP1SMN1; SMN2
SCHEMBL10656338 0.84 MAPT (0.50) CYP3A4TSHRMAPK1TDP1SMN1; SMN2
SCHEMBL10566685 0.82 MAPT (0.43) CYP3A4TSHRMAPK1TDP1SMN1; SMN2
SCHEMBL10365134 0.82 CYP3A4 (0.43) CYP3A4TSHRMAPK1TDP1SMN1; SMN2
SCHEMBL10365133 0.82 CYP3A4 (0.43) CYP3A4TSHRMAPK1TDP1SMN1; SMN2
SCHEMBL10566683 0.82 MAPT (0.43) CYP3A4TSHRMAPK1TDP1SMN1; SMN2
SCHEMBL10364565 0.80 MAPT (0.56) CYP3A4TSHRMAPK1TDP1SMN1; SMN2
SCHEMBL10364563 0.80 MAPT (0.56) CYP3A4TSHRMAPK1TDP1SMN1; SMN2
Hydrochloric Acid SCHEMBL10568449 0.79 TSHR (0.57) CYP3A4TSHRMAPK1TDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4824851-A Pyrimidones as cardiotonic, anti hypertensive, cerebrovascular vasodilator and anti-platelet agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-04-25 US disclosed
US-4746664-A Substituted-3,4-dihydro-4-(2,4,6-trimethoxyphenylimino)-2(1H)-pyrimidones useful as cardiotonic, antihypertensive, cerebrovascular vasodilator and anti-platelet agent FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-05-24 US disclosed
US-4612376-A Substituted-3,4-dihydro-4-(2,4,6-trimethoxyphenylimino)-2(1H)-pyrimidones useful as cardiotonic, antihypertensive, cerebrovascular vasodilator and anti-platelet agent FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-09-16 US disclosed
EP-0123402-A2 Pyrimidine derivatives, preparation thereof and use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-10-31 EP disclosed