SCHEMBL30231563

SCHEMBL30231563

CCOC[C@@H](Oc1ccc2c(-c3ccccc3C)cc(=O)oc2c1)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 2/20 0.52
▸ ALDH1A1 P00352 10/20 0.51
▸ KDM4E B2RXH2 4/20 0.51
▸ HTT P42858 2/20 0.51
▸ LMNA P02545 2/20 0.51
▸ RECQL P46063 1/20 0.51
▸ HPGD P15428 8/20 0.47
▸ KMT2A Q03164 3/20 0.46
▸ IGLV6-57 P01721 4/20 0.46
▸ HSD17B10 Q99714 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ USP2 O75604 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ KCNA3 P22001 1/20 0.43
▸ GAA P10253 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ GLA P06280 1/20 0.42

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
SCHEMBL30231580 1.00 AR (0.52) ARALDH1A1KDM4EHTTLMNA
SCHEMBL30231536 0.91 ALDH1A1 (0.54) ARALDH1A1KDM4EHTTLMNA
SCHEMBL30231661 0.91 AR (0.61) ARALDH1A1KDM4EHTTLMNA
SCHEMBL30231491 0.82 ALDH1A1 (0.51) ARALDH1A1KDM4EHTTLMNA
SCHEMBL30231440 0.82 ALDH1A1 (0.51) ARALDH1A1KDM4EHTTLMNA
SCHEMBL30231415 0.81 ALDH1A1 (0.54) ARALDH1A1KDM4EHTTLMNA
SCHEMBL30231271 0.81 ALDH1A1 (0.54) ARALDH1A1KDM4EHTTLMNA
SCHEMBL20839098 0.81 ALDH1A1 (0.64) ARALDH1A1KDM4EHTTLMNA
SCHEMBL30231757 0.81 ALDH1A1 (0.59) ARALDH1A1KDM4EHTTLMNA
SCHEMBL30231515 0.81 ALDH1A1 (0.59) ARALDH1A1KDM4EHTTLMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023034339-A1 HYDROXY AND ALKOXY COUMARINS AS MODULATORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2023-03-09 — — WO disclosed
WO-2023034340-A1 HYDROXY AND ALKOXY COUMARINS AS MODULATORS OF POLRMT PRETZEL THERAPEUTICS, INC. (US) 2023-03-09 — — WO disclosed
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