SCHEMBL10568492

SCHEMBL10568492

COc1ccc(-c2cc(=S)n(C)c(=O)n2C)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHR1 P34998 3/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ MPO P05164 2/20 0.37
▸ TLR8 Q9NR97 1/20 0.37
▸ RAD52 P43351 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ PKM P14618 1/20 0.36
▸ BRPF1 P55201 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA4 P22748 1/20 0.36
▸ CA7 P43166 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ HTT P42858 1/20 0.35
▸ HTR3E A5X5Y0 1/20 0.35
▸ HTR3B O95264 1/20 0.35
▸ HTR3A P46098 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
SCHEMBL10563856 0.85 ALDH1A1 (0.44) CRHR1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL10567037 0.79 ALDH1A1 (0.43) KDM4ESMN1; SMN2PKMHTT
SCHEMBL10566510 0.78 CYP3A4 (0.51) CRHR1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL10566515 0.78 CYP3A4 (0.51) CRHR1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL10568135 0.74 CYP19A1 (0.40) KDM4ESMN1; SMN2HTT
SCHEMBL17178254 0.74 CRHR1 (0.42) CRHR1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL29079816 0.70 MEN1 (0.39) CRHR1L3MBTL1TLR8RAD52HTR3E
SCHEMBL12326180 0.70 CA1 (0.50) KDM4ECYP1A2CYP3A4CA1CA2
SCHEMBL10658403 0.69 CYP3A4 (0.54) CRHR1KDM4ECYP1A2CYP3A4MPO
SCHEMBL10567603 0.68 KDM4E (0.42) L3MBTL1KDM4ECA1CA2

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 5 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
EP-0123402-B1 PYRIMIDINE DERIVATIVES, PREPARATION THEREOF AND USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-09-07 — — EP 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
Send feedback