SCHEMBL29565507

SCHEMBL29565507

CCC(=O)N(C)Cc1cccc(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.65
▸ AOC3 Q16853 5/20 0.59
▸ GAA P10253 1/20 0.50
▸ TACR1 P25103 1/20 0.50
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ PYCR1 P32322 1/20 0.49
▸ RAB9A P51151 3/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ TAAR1 Q96RJ0 1/20 0.47
▸ PABPC1 P11940 1/20 0.47
▸ ALOX5 P09917 1/20 0.47

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
SCHEMBL17278345 0.87 RIPK1 (0.61) RIPK1AOC3GAATACR1MEN1
SCHEMBL9824208 0.83 RIPK1 (0.64) RIPK1AOC3GAATSHRRECQL
SCHEMBL14524623 0.82 HSP90AA1 (0.53) RIPK1AOC3MEN1KMT2ARAB9A
SCHEMBL29565583 0.81 RIPK1 (0.65) RIPK1AOC3GAAMEN1KMT2A
SCHEMBL29565561 0.81 AOC3 (0.49) RIPK1AOC3MEN1KMT2ARAB9A
SCHEMBL29565351 0.81 RIPK1 (0.65) RIPK1AOC3MEN1KMT2ARAB9A
SCHEMBL14946472 0.80 RIPK1 (0.60) RIPK1AOC3GAATACR1MEN1
SCHEMBL14540715 0.79 RIPK1 (0.59) RIPK1AOC3GAATACR1MEN1
SCHEMBL25711795 0.79 RIPK1 (0.59) RIPK1AOC3GAATACR1MEN1
SCHEMBL3163935 0.79 NPC1 (0.75) RIPK1AOC3MEN1KMT2ARAB9A

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
CN-114539121-A A novel, photo-promoted process for the preparation of sulfonates and sulfonamides from sulfonyl chlorides 天津师范大学 2022-05-27 — — CN disclosed
Send feedback