SCHEMBL8196872

SCHEMBL8196872

CC1(c2ccc(Cl)cc2Cl)OO1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.43
CYP3A4 P08684 2/20 0.43
TP53 P04637 2/20 0.42
SLC6A4 P31645 4/20 0.41
SLC6A3 Q01959 4/20 0.41
HSD17B10 Q99714 1/20 0.38
HCAR2 Q8TDS4 1/20 0.37
LMNA P02545 3/20 0.37
ALDH1A1 P00352 2/20 0.37
USP2 O75604 2/20 0.37
KDM4E B2RXH2 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 2/20 0.36
ALOX15 P16050 1/20 0.36
SLC6A2 P23975 1/20 0.36
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL2662444 0.82 SLC6A4 (0.41) TSHRCYP3A4TP53SLC6A4SLC6A3
SCHEMBL2171978 0.75 SLC6A4 (0.42) TSHRCYP3A4TP53SLC6A4SLC6A3
SCHEMBL9921757 0.74 SLC6A3 (0.49) TSHRCYP3A4TP53SLC6A4SLC6A3
SCHEMBL8204831 0.74 TSHR (0.43) TSHRCYP3A4TP53SLC6A4SLC6A3
SCHEMBL18857047 0.74 USP2 (0.47) TSHRCYP3A4LMNAALDH1A1USP2
SCHEMBL18258279 0.71 USP2 (0.56) TSHRCYP3A4LMNAALDH1A1USP2
SCHEMBL18258310 0.71 USP2 (0.56) TSHRCYP3A4LMNAALDH1A1USP2
SCHEMBL18258309 0.71 USP2 (0.56) TSHRCYP3A4LMNAALDH1A1USP2
SCHEMBL19186356 0.71 USP2 (0.56) TSHRCYP3A4LMNAALDH1A1USP2
SCHEMBL18258274 0.71 USP2 (0.56) TSHRCYP3A4LMNAALDH1A1USP2

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-6093851-A N-(α-alkylbenzylidene)-α-phenylalkylamine, its use and process for producing the same and process for producing intermediate therefor SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2000-07-25 US disclosed