SCHEMBL29998549

SCHEMBL29998549

C=C(C)C1Cc2cc(C=CC(=O)O)ccc2O1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.48
▸ POLB P06746 2/20 0.46
▸ APEX1 P27695 2/20 0.46
▸ RECQL P46063 1/20 0.46
▸ ALDH1A1 P00352 5/20 0.45
▸ GAA P10253 4/20 0.45
▸ HPGD P15428 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ MAPK1 P28482 3/20 0.45
▸ PTGS2 P35354 3/20 0.41
▸ HSD17B10 Q99714 4/20 0.40
▸ ALOX5 P09917 2/20 0.40
▸ CA12 O43570 2/20 0.40
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ CA3 P07451 2/20 0.40
▸ CA4 P22748 2/20 0.40
▸ CA6 P23280 2/20 0.40
▸ CA5A P35218 2/20 0.40

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
SCHEMBL22013648 0.81 TDP1 (0.58) KDM4EPOLBAPEX1ALDH1A1GAA
Tremetone SCHEMBL4743839 0.75 POLB (0.75) KDM4EPOLBAPEX1RECQLALDH1A1
Tremetone SCHEMBL4743840 0.75 POLB (0.75) KDM4EPOLBAPEX1RECQLALDH1A1
SCHEMBL3375377 0.73 AKR1C3 (0.54) ALOX5AKR1B10AKR1B1MMP2NFKB1
SCHEMBL3375374 0.73 AKR1C3 (0.54) ALOX5AKR1B10AKR1B1MMP2NFKB1
SCHEMBL29999634 0.73 KDM4E (0.49) KDM4EPOLBAPEX1ALDH1A1GAA
SCHEMBL20594954 0.70 POLB (0.52) KDM4EPOLBAPEX1RECQLALDH1A1
SCHEMBL14898033 0.68 KDM4E (0.50) KDM4EPOLBAPEX1ALDH1A1GAA
SCHEMBL21962337 0.68 KDM4E (0.69) KDM4EPOLBAPEX1ALDH1A1GAA
SCHEMBL2717768 0.68 KDM4E (0.69) KDM4EPOLBAPEX1ALDH1A1GAA

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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