SCHEMBL11272041

SCHEMBL11272041

CC(C)OC(C(=O)O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
PPARA Q07869 4/20 0.43
CYP3A4 P08684 4/20 0.43
CYP2D6 P10635 3/20 0.43
MAPT P10636 3/20 0.43
CYP1A2 P05177 3/20 0.43
CYP2C19 P33261 3/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
MIF P14174 1/20 0.42
CYP2C9 P11712 4/20 0.41
HIF1A Q16665 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL7174341 0.82 ALDH1A1 (0.39) MEN1KMT2ACYP3A4CYP2D6MAPT
SCHEMBL7876582 0.79 MEN1 (0.47) MEN1KMT2APPARACYP3A4CYP2D6
SCHEMBL11596659 0.77 MIF (0.47) MEN1KMT2APPARACYP3A4CYP2D6
SCHEMBL7171746 0.75 MIF (0.46) MEN1KMT2APPARACYP3A4CYP2D6
SCHEMBL9291597 0.75 MEN1 (0.43) MEN1KMT2APPARACYP3A4CYP2D6
SCHEMBL11598088 0.72 MEN1 (0.66) MEN1KMT2APPARACYP3A4CYP2D6
SCHEMBL10334690 0.71 CYP3A4 (0.46) MEN1KMT2APPARACYP3A4CYP2D6
SCHEMBL11168281 0.70 KMT2A (0.50) MEN1KMT2APPARACYP3A4CYP2D6
SCHEMBL22722998 0.70 KMT2A (0.50) MEN1KMT2APPARACYP3A4CYP2D6
SCHEMBL22722989 0.70 KMT2A (0.50) MEN1KMT2APPARACYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4323680-A 4-Aminoquinazoline compounds useful as agricultural fungicides SANKYO COMPANY LIMITED (JP) 1982-04-06 US disclosed
US-4220663-A Combating pests with benzyl phenyl ethers BAYER AKTIENGESELLSCHAFT (DE) 1980-09-02 US disclosed
US-4213987-A 4-AMINOQUINAZOLINES SANKYO COMPANY LIMITED (JP) 1980-07-22 US disclosed
US-4145439-A NEMATOCIDES, FUNGICIDES, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1979-03-20 US disclosed
US-4058604-A OR ACARICIDALLY ACTIVE SUBSTANCES CIBA-GEIGY AG (CH) 1977-11-15 US disclosed
US-4048315-A NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-09-13 US disclosed
US-3980799-A OR ACARICIDALLY ACTIVE SUBSTANCES CIBA-GEIGY AG (CH) 1976-09-14 US disclosed
US-3940412-A 2,4,5-Trichloro- and 2,4,5-tribromoimidazole derivatives and pesticidal compositions containing them CIBA-GEIGY AG (CH) 1976-02-24 US disclosed
US-3932632-A Insecticidal compositions containing an organophosphorus compound and a thiolcarbamate BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1976-01-13 US disclosed