SCHEMBL29999634

SCHEMBL29999634

CC1(C)Oc2ccc(C=CC(=O)O)cc2CC1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.49
▸ ESR1 P03372 1/20 0.45
▸ ESR2 Q92731 1/20 0.45
▸ PTPN1 P18031 3/20 0.44
▸ GAA P10253 2/20 0.44
▸ MGAM O43451 1/20 0.44
▸ SI P14410 1/20 0.44
▸ ACHE P22303 1/20 0.44
▸ MGAM2 Q2M2H8 1/20 0.44
▸ ALOX5 P09917 2/20 0.43
▸ HSD17B10 Q99714 4/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ HIF1A Q16665 2/20 0.41
▸ CA12 O43570 2/20 0.41
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA3 P07451 2/20 0.41
▸ CA4 P22748 2/20 0.41

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
SCHEMBL29999195 0.83 PTPN1 (0.45) KDM4EPTPN1GAAMGAMSI
SCHEMBL29216337 0.83 PTPN1 (0.45) KDM4EPTPN1GAAMGAMSI
SCHEMBL9101771 0.80 KDM4E (0.52) KDM4EESR1ESR2PTPN1GAA
SCHEMBL9101781 0.80 KDM4E (0.52) KDM4EESR1ESR2PTPN1GAA
SCHEMBL14898033 0.77 KDM4E (0.50) KDM4EPTPN1GAAALOX5HSD17B10
SCHEMBL22013648 0.77 TDP1 (0.58) KDM4EPTPN1GAAALOX5HSD17B10
SCHEMBL15397966 0.74 AKR1C3 (0.54) PTPN1ALOX5AKR1B10AKR1B1MMP2
SCHEMBL15397968 0.74 AKR1C3 (0.54) PTPN1ALOX5AKR1B10AKR1B1MMP2
SCHEMBL7597293 0.74 KDM4E (0.52) KDM4EESR1ESR2PTPN1GAA
SCHEMBL7597289 0.74 KDM4E (0.52) KDM4EESR1ESR2PTPN1GAA

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
EP-4346810-A1 COMPOSITIONS FOR REGULATING HOMEOSTASIS OF CORTISOL AND IMPROVING SLEEP QUALITY AND METHODS OF USE AND PRODUCTION THEREOF Unigen, Inc. (US) 2024-04-10 — — EP disclosed
WO-2022256624-A1 COMPOSITIONS FOR REGULATING HOMEOSTASIS OF CORTISOL AND IMPROVING SLEEP QUALITY AND METHODS OF USE AND PRODUCTION THEREOF UNIGEN, INC. (US) 2022-12-08 — — WO disclosed
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