SCHEMBL17355772

SCHEMBL17355772

COC(=O)Oc1c(Cl)cc(C)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.41
ALDH1A1 P00352 6/20 0.41
GAA P10253 1/20 0.41
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TAS1R3 Q7RTX0 2/20 0.39
TAS1R1 Q7RTX1 2/20 0.39
TAS1R2 Q8TE23 2/20 0.39
CUL4A Q13619 1/20 0.39
HTT P42858 1/20 0.39
TSHR P16473 1/20 0.39
HPGD P15428 3/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38
TPMT P51580 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 2/20 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
SCHEMBL27601397 0.86 POLB (0.41) KDM4EALDH1A1GAACYP1A2CYP2D6
SCHEMBL19546119 0.86 ALDH1A1 (0.42) KDM4EALDH1A1GAACYP1A2CYP2D6
SCHEMBL19543130 0.83 TDP1 (0.38) KDM4EALDH1A1TDP1CUL4AHTT
SCHEMBL17355801 0.82 ALDH1A1 (0.42) KDM4EALDH1A1GAACYP1A2CYP2D6
SCHEMBL19543205 0.81 CUL4A (0.52) KDM4EALDH1A1CUL4AHTTTSHR
SCHEMBL14628855 0.81 PPARA (0.47) KDM4EALDH1A1GAATDP1TAS1R3
SCHEMBL28740318 0.81 TPMT (0.59) KDM4EALDH1A1GAATAS1R3TAS1R1
SCHEMBL9682715 0.79 RAPGEF4 (0.41) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL5688964 0.79 LMNA (0.43) KDM4EALDH1A1GAATDP1HTT
SCHEMBL19543127 0.78 ELANE (0.39) KDM4EALDH1A1GAACYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE HCN2, SCO2, HCN1 KDM4E 1067/4885ALDH1A1 1059/4885GAA 3610/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.