SCHEMBL23879337

SCHEMBL23879337

Oc1cc(Cl)c(Cl)c(Cl)c1Cl.Oc1cccc(Cl)c1Cl

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 10/20 0.71
HSD17B10 Q99714 8/20 0.67
HPGD P15428 6/20 0.67
CYP3A4 P08684 5/20 0.67
HSP90AA1 P07900 1/20 0.67
MAPK1 P28482 2/20 0.54
ALDH1A1 P00352 3/20 0.46
KIF11 P52732 1/20 0.40
AR P10275 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
CASP1 P29466 1/20 0.36
NQO2 P16083 1/20 0.35
AHR P35869 1/20 0.35
PNMT P11086 1/20 0.34

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
SCHEMBL134755 0.84
SCHEMBL30631964 0.84
SCHEMBL30091824 0.82 TSHR (0.94) TSHRHSD17B10HPGDCYP3A4MAPK1
SCHEMBL31252200 0.82 TSHR (0.94) TSHRHSD17B10HPGDCYP3A4MAPK1
Ammonia Solution, Strong SCHEMBL29156113 0.82 TSHR (0.94) TSHRHSD17B10HPGDCYP3A4MAPK1
Hydrochloric Acid SCHEMBL9797291 0.82 TSHR (0.94) TSHRHSD17B10HPGDCYP3A4MAPK1
SCHEMBL5842280 0.82 TSHR (0.94) TSHRHSD17B10HPGDCYP3A4MAPK1
SCHEMBL31006506 0.82 TSHR (0.94) TSHRHSD17B10HPGDCYP3A4MAPK1
Phosphine SCHEMBL29064576 0.82 TSHR (0.94) TSHRHSD17B10HPGDCYP3A4MAPK1
Methane SCHEMBL28589037 0.82 TSHR (0.94) TSHRHSD17B10HPGDCYP3A4MAPK1

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
EP-3888691-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LIKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS Hangzhou Dac Biotech Co., Ltd. (CN) 2021-10-06 EP disclosed