SCHEMBL20439246

SCHEMBL20439246

CC(C)(N)c1ccccc1C(C)(C)I

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TAAR1 Q96RJ0 2/20 0.34
SLC6A2 P23975 1/20 0.34
CA2 P00918 1/20 0.32
KCNN4 O15554 2/20 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
SCHEMBL48365 0.87 ALDH1A1 (0.43) ALDH1A1TSHRTDP1TAAR1SLC6A2
SCHEMBL30678520 0.87 ALDH1A1 (0.43) ALDH1A1TSHRTDP1TAAR1SLC6A2
SCHEMBL2868262 0.87 TSHR (0.43) ALDH1A1TSHRTDP1TAAR1SLC6A2
SCHEMBL20439254 0.79 TDP1 (0.50) ALDH1A1TSHRTDP1TAAR1SLC6A2
SCHEMBL18364918 0.79 ALDH1A1 (0.50) ALDH1A1TSHRTDP1CA2
SCHEMBL23862430 0.75 CA2 (0.37) ALDH1A1TSHRTDP1CA2
SCHEMBL4500149 0.75 ALDH1A1 (0.45) ALDH1A1TSHRTDP1
SCHEMBL26725213 0.75 CYP3A4 (0.43) ALDH1A1TSHRTDP1CA2
SCHEMBL29581427 0.72 TSHR (0.45) ALDH1A1TSHRTDP1TAAR1SLC6A2
SCHEMBL164361 0.72 TSHR (0.45) ALDH1A1TSHRTDP1TAAR1SLC6A2

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-20180216107-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2018-08-02 US disclosed