SCHEMBL18334259

SCHEMBL18334259

COCCOC(C)C(=O)I

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL18787662 0.81 ALDH1A1 (0.37) TSHRALDH1A1
SCHEMBL2557233 0.81 ALDH1A1 (0.37) TSHRALDH1A1
SCHEMBL17928482 0.81 MGAM (0.33) TSHRALDH1A1
SCHEMBL17293162 0.81 ALDH1A1 (0.37) TSHRALDH1A1
SCHEMBL7080897 0.81 TSHR (0.32) TSHRALDH1A1
SCHEMBL2152125 0.79 SMN1; SMN2 (0.38) TSHRALDH1A1
SCHEMBL18357023 0.79 TSHR (0.39) TSHRALDH1A1
SCHEMBL14194812 0.76 MEN1 (0.34) TSHRALDH1A1
SCHEMBL5830956 0.76 KMT2A (0.34) ALDH1A1
SCHEMBL21877045 0.76 KMT2A (0.34) ALDH1A1

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
WO-2016205202-A1 TREPROSTINIL DERIVATIVES AND COMPOSITIONS AND USES THEREOF Corsair Pharma, Inc. (US) 2016-12-22 WO disclosed