SCHEMBL30231604

SCHEMBL30231604

CCC(COC)Oc1ccc2c(-c3ccccc3C)cc(=O)oc2c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ IGLV6-57 P01721 5/20 0.52
▸ ALDH1A1 P00352 8/20 0.52
▸ KDM4E B2RXH2 4/20 0.52
▸ RECQL P46063 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ HPGD P15428 7/20 0.50
▸ AR P10275 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ KCNA3 P22001 1/20 0.46
▸ KMT2A Q03164 1/20 0.45
▸ MAPT P10636 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ ALDH2 P05091 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
SCHEMBL30231555 0.87 IGLV6-57 (0.57) IGLV6-57ALDH1A1KDM4ERECQLLMNA
SCHEMBL30231415 0.84 ALDH1A1 (0.54) IGLV6-57ALDH1A1KDM4ERECQLLMNA
SCHEMBL30231414 0.84 ALDH1A1 (0.54) IGLV6-57ALDH1A1KDM4ERECQLLMNA
SCHEMBL30231699 0.84 ALDH1A1 (0.54) IGLV6-57ALDH1A1KDM4ERECQLLMNA
SCHEMBL30231271 0.84 ALDH1A1 (0.54) IGLV6-57ALDH1A1KDM4ERECQLLMNA
SCHEMBL30231679 0.83 ALDH1A1 (0.59) IGLV6-57ALDH1A1KDM4ERECQLLMNA
SCHEMBL30231379 0.83 ALDH1A1 (0.59) IGLV6-57ALDH1A1KDM4ERECQLLMNA
SCHEMBL30231486 0.83 ALDH1A1 (0.59) IGLV6-57ALDH1A1KDM4ERECQLLMNA
SCHEMBL30231961 0.81 MAPT (0.56) IGLV6-57ALDH1A1KDM4ELMNAHPGD
SCHEMBL30231784 0.80 KDM4E (0.67) ALDH1A1KDM4ERECQLLMNAHPGD

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
Send feedback