SCHEMBL28412656

SCHEMBL28412656

N#CC/C=C/c1cc(Cl)c(Cl)c(Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
ALDH1A1 P00352 1/20 0.33
AHR P35869 2/20 0.31
CYP1B1 Q16678 1/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL28197282 0.74 ALDH1A1 (0.36) ALDH1A1AHRCYP3A4HPGDCRHBP
SCHEMBL2622604 0.69 ALDH1A1 (0.45) TSHRALDH1A1AHRCYP1B1CYP3A4
SCHEMBL20076653 0.68 AHR (0.42) ALDH1A1AHRCYP1B1CYP3A4HPGD
SCHEMBL3012608 0.67 MAOB (0.49)
SCHEMBL1002069 0.67 MAOB (0.49)
SCHEMBL9114095 0.66 ALDH1A1 (0.41) TSHRALDH1A1AHRCYP1B1CYP3A4
SCHEMBL9114088 0.66 ALDH1A1 (0.41) TSHRALDH1A1AHRCYP1B1CYP3A4
SCHEMBL11039432 0.65 ALDH1A1 (0.36) ALDH1A1AHRCYP3A4HPGDCRHBP
SCHEMBL11039430 0.65 ALDH1A1 (0.36) ALDH1A1AHRCYP3A4HPGDCRHBP
SCHEMBL2869225 0.64 KDM4E (0.42) TSHRALDH1A1AHRCYP1B1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111118235-B Method for tanning leather by external electric field 温州大学 2022-04-01 CN disclosed
CN-111118235-A Method for tanning leather by external electric field 温州大学 2020-05-08 CN disclosed