SCHEMBL10458013

SCHEMBL10458013

CC(=O)Oc1ccc2c(C)cccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
KDM4E B2RXH2 4/20 0.51
GLA P06280 3/20 0.51
GAA P10253 3/20 0.51
CYP3A4 P08684 1/20 0.50
CYP1A2 P05177 1/20 0.50
ALDH1A1 P00352 1/20 0.50
PKM P14618 1/20 0.49
ACHE P22303 2/20 0.49
PDGFRB P09619 1/20 0.47
FGFR1 P11362 1/20 0.47
PDGFRA P16234 1/20 0.47
MAPT P10636 1/20 0.46
CA12 O43570 2/20 0.45
CA9 Q16790 2/20 0.45
FLT3 P36888 1/20 0.45
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45
GAPDH P04406 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL10458103 0.87 LMNA (0.54) LMNAKDM4EGLAGAACYP3A4
SCHEMBL10458485 0.86 ELANE (0.46) LMNAKDM4EGLAGAACYP1A2
SCHEMBL9476254 0.83 KDM4E (0.50) LMNAKDM4EGAACYP3A4ALDH1A1
SCHEMBL27529724 0.83 CYP3A4 (0.54) LMNAKDM4EGLAGAACYP3A4
SCHEMBL10458006 0.83 ACHE (0.52) LMNAKDM4EGLAGAACYP1A2
SCHEMBL27537425 0.82 LMNA (0.49) LMNAKDM4EGLAGAACYP3A4
Acetic Acid SCHEMBL7936063 0.82 MTNR1A (0.53) KDM4ECYP1A2ALDH1A1FLT3MTNR1A
SCHEMBL29559115 0.81 MAPT (0.57) LMNAKDM4EGLAGAACYP3A4
SCHEMBL8941764 0.81 MAPT (0.57) LMNAKDM4EGLAGAACYP3A4
Acetic Acid SCHEMBL9228333 0.81 MTNR1A (0.52) KDM4ECYP1A2ALDH1A1FLT3MTNR1A

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-4935537-A OXIDIZING ACYLALKYLNAPHTHALENE WITH PEROXIDE, OXIDIZING PRODUCT WITH OXYGEN USING CATALYST CONTAINING COBALT AND BROMINE COMPOUNDS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1990-06-19 US disclosed
US-4801737-A Process for producing acyloxynaphthoic acids MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1989-01-31 US disclosed
EP-0170273-B1 PROCESS FOR PRODUCING ACYLOXYNAPHTHOIC ACIDS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1988-12-28 EP disclosed
EP-0170273-A2 Process for producing acyloxynaphthoic acids MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1986-02-05 EP disclosed