SCHEMBL23486400

SCHEMBL23486400

N#CB1CCC(C(=O)N2CCOCC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ POLB P06746 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ RECQL P46063 1/20 0.46
▸ PKM P14618 1/20 0.44
▸ ALDH1A1 P00352 5/20 0.43
▸ HTT P42858 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ DPP4 P27487 1/20 0.43
▸ MAPK1 P28482 1/20 0.41
▸ CHRM4 P08173 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL11158442 0.78 TSHR (0.65) TSHRSMN1; SMN2POLBHPGDRECQL
SCHEMBL23486737 0.77 CHRNB2 (0.42) TSHRHPGDALDH1A1
SCHEMBL20405434 0.75 ALDH1A1 (0.61) TSHRSMN1; SMN2POLBHPGDRECQL
SCHEMBL11184712 0.73 ALDH1A1 (0.72) TSHRSMN1; SMN2POLBHPGDRECQL
SCHEMBL2952745 0.72 TSHR (0.57) TSHRSMN1; SMN2POLBHPGDRECQL
SCHEMBL3087285 0.72 TSHR (0.57) TSHRSMN1; SMN2POLBHPGDRECQL
SCHEMBL3087287 0.72 TSHR (0.57) TSHRSMN1; SMN2POLBHPGDRECQL
SCHEMBL13194529 0.72 TSHR (0.57) TSHRSMN1; SMN2POLBHPGDRECQL
SCHEMBL2952742 0.72 TSHR (0.57) TSHRSMN1; SMN2POLBHPGDRECQL
SCHEMBL2077746 0.70 TSHR (0.65) TSHRSMN1; SMN2POLBHPGDRECQL

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-2021110076-A1 OXAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE 深圳信立泰药业股份有限公司 2021-06-10 — — WO disclosed
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