SCHEMBL30231555

SCHEMBL30231555

COCC(C)Oc1ccc2c(-c3ccccc3C)cc(=O)oc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IGLV6-57 P01721 5/20 0.57
▸ ALDH1A1 P00352 8/20 0.52
▸ HPGD P15428 7/20 0.52
▸ KDM4E B2RXH2 6/20 0.51
▸ HSD17B10 Q99714 3/20 0.51
▸ RECQL P46063 2/20 0.48
▸ HTT P42858 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ AR P10275 1/20 0.48
▸ ALDH2 P05091 1/20 0.48
▸ KCNA3 P22001 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ TOP1 P11387 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ USP2 O75604 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46

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
SCHEMBL30231604 0.87 IGLV6-57 (0.52) IGLV6-57ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL30231415 0.86 ALDH1A1 (0.54) IGLV6-57ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL30231414 0.86 ALDH1A1 (0.54) IGLV6-57ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL30231271 0.86 ALDH1A1 (0.54) IGLV6-57ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL30231699 0.86 ALDH1A1 (0.54) IGLV6-57ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL30231486 0.85 ALDH1A1 (0.59) IGLV6-57ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL30231679 0.85 ALDH1A1 (0.59) IGLV6-57ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL30231379 0.85 ALDH1A1 (0.59) IGLV6-57ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL30231539 0.84 IGLV6-57 (0.44) IGLV6-57ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL30231784 0.82 KDM4E (0.67) ALDH1A1HPGDKDM4EHSD17B10RECQL

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