SCHEMBL11269485

SCHEMBL11269485

C=C(C)C.O=C1CCC(=O)O1.O=C1CCC(=O)O1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.65
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL9724356 1.00 TSHR (0.65) TSHRALDH1A1LMNATP53
SCHEMBL21259 1.00 TSHR (0.65) TSHRALDH1A1LMNATP53
SCHEMBL28533853 0.97 TSHR (0.61) TSHRALDH1A1LMNATP53
SCHEMBL28743003 0.97 TSHR (0.61) TSHRALDH1A1LMNATP53
SCHEMBL27368492 0.97 TSHR (0.61) TSHRALDH1A1LMNATP53
Ethylene SCHEMBL29140016 0.97 TSHR (0.61) TSHRALDH1A1LMNATP53
Ammonia Solution, Strong SCHEMBL2373983 0.97 TSHR (0.61) TSHRALDH1A1LMNATP53
Hydroxyamine SCHEMBL27346314 0.95 TSHR (0.58) TSHRALDH1A1LMNATP53
SCHEMBL28539245 0.92 TSHR (0.61) TSHRALDH1A1LMNATP53
Ethylene Glycol SCHEMBL29140022 0.90 TSHR (0.52) TSHR

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-1982000466-A1 POLYALKENYL BIS(SUCCINIC ANHYDRIDES OR ACIDS)THEIR PREPARATION AND USE CANE C 1982-02-18 WO disclosed