SCHEMBL25711795

SCHEMBL25711795

CN(Cc1cccc(Cl)c1)C(=O)C(O)O

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.59
▸ TSHR P16473 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ AOC3 Q16853 4/20 0.51
▸ GAA P10253 2/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ PYCR1 P32322 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ TAAR1 Q96RJ0 1/20 0.46
▸ ALOX5 P09917 1/20 0.46
▸ TACR1 P25103 1/20 0.46
▸ HPGD P15428 1/20 0.45
▸ TP53 P04637 1/20 0.44
▸ PABPC1 P11940 1/20 0.44
▸ PNMT P11086 1/20 0.44

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
SCHEMBL14540715 0.88 RIPK1 (0.59) RIPK1TSHRRECQLAOC3GAA
SCHEMBL9824208 0.82 RIPK1 (0.64) RIPK1TSHRRECQLAOC3GAA
SCHEMBL17278345 0.79 RIPK1 (0.61) RIPK1TSHRRECQLAOC3GAA
SCHEMBL29565507 0.79 RIPK1 (0.65) RIPK1TSHRRECQLAOC3GAA
SCHEMBL17887629 0.78 RIPK1 (0.58) RIPK1TSHRRECQLAOC3GAA
SCHEMBL14946472 0.76 RIPK1 (0.60) RIPK1TSHRRECQLAOC3GAA
SCHEMBL14344795 0.76 RIPK1 (0.56) RIPK1TSHRRECQLAOC3GAA
SCHEMBL9209224 0.75 TSHR (0.55) RIPK1TSHRRECQLAOC3GAA
SCHEMBL9214534 0.75 TSHR (0.55) RIPK1TSHRRECQLAOC3GAA
SCHEMBL17882179 0.75 RIPK1 (1.00) RIPK1AOC3GAA

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-2023092094-A2 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF THE BROAD INSTITUTE, INC. (US) 2023-05-25 — — WO disclosed
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