SCHEMBL4445353

SCHEMBL4445353

c1ccc2c(c1)OCc1cc3ccccc3nc1-2

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.61
MAPT P10636 8/20 0.61
TP53 P04637 5/20 0.61
SMN1; SMN2 Q16637 5/20 0.61
CYP3A4 P08684 5/20 0.61
CYP2C9 P11712 5/20 0.61
CYP2C19 P33261 5/20 0.61
KMT2A Q03164 4/20 0.61
CYP2D6 P10635 4/20 0.61
HSD17B10 Q99714 4/20 0.61
MAPK1 P28482 4/20 0.61
MEN1 O00255 3/20 0.61
PKM P14618 3/20 0.61
TSHR P16473 3/20 0.61
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
ALDH1A1 P00352 11/20 0.48
HPGD P15428 7/20 0.48
THRB P10828 1/20 0.46
LMNA P02545 2/20 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
SCHEMBL29615690 1.00 KDM4E (0.61) KDM4EMAPTTP53SMN1; SMN2CYP3A4
SCHEMBL27188738 0.81 KDM4E (0.53) KDM4EMAPTTP53SMN1; SMN2CYP3A4
SCHEMBL4814056 0.80 RAB9A (0.46) KDM4EMAPTTP53SMN1; SMN2CYP3A4
SCHEMBL9227523 0.79 MAPT (0.45) KDM4EMAPTTP53SMN1; SMN2CYP3A4
SCHEMBL4815082 0.79 MAPT (0.48) KDM4EMAPTTP53SMN1; SMN2CYP3A4
SCHEMBL11533852 0.78 KDM4E (0.49) KDM4EMAPTTP53SMN1; SMN2CYP3A4
SCHEMBL5264214 0.76 MAPT (1.00) KDM4EMAPTTP53SMN1; SMN2CYP3A4
SCHEMBL8209185 0.76 KDM4E (0.74) KDM4EMAPTTP53SMN1; SMN2CYP3A4
SCHEMBL30617062 0.76 MAPT (1.00) KDM4EMAPTTP53SMN1; SMN2CYP3A4
SCHEMBL29479235 0.76 KDM4E (0.74) KDM4EMAPTTP53SMN1; SMN2CYP3A4

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230114408-A1 METHODS OF MODULATING T-CELL ACTIVATION USING ESTROGEN RECEPTOR BETA (ERB) AGONISTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-04-13 US disclosed
WO-2021183760-A1 METHODS OF MODULATING T-CELL ACTIVATION USING ESTROGEN RECEPTOR BETA (ERΒ) AGONISTS OHIO STATE INNOVATION FOUNDATION (US) 2021-09-16 WO disclosed
WO-2020160225-A1 ESTROGEN RECEPTOR BETA (ERβ) AGONISTS FOR THE TREATMENT OF FIBROTIC CONDITIONS OHIO STATE INNOVATION FOUNDATION (US) 2020-08-06 WO disclosed
EP-2125825-A1 ABCA1 ELEVATING COMPOUNDS CV THERAPEUTICS, INC. (US) 2009-12-02 EP disclosed
US-20080293757-A1 ABCA1 ELEVATING COMPOUNDS ABELMAN MATTHEW 2008-11-27 US disclosed
US-7432276-B2 ABCA1 elevating compounds CV THERAPEUTICS, INC. (US) 2008-10-07 US disclosed
US-7423045-B2 ABCA1 elevating compounds CV THERAPEUTICS, INC. (US) 2008-09-09 US disclosed
WO-2008079139-A1 ABCA1 ELEVATING COMPOUNDS CV THERAPEUTICS, INC. (US) 2008-07-03 WO disclosed
US-7354927-B2 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents WYETH (US) 2008-04-08 US disclosed
US-7354927-B2 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents WYETH (US) 2008-04-08 US disclosed
US-20070191379-A1 ABCA1 elevating compounds CV THERAPEUTICS, INC. 2007-08-16 US disclosed
EP-1789420-A2 6H-[1]BENZOPYRANO[4,3-b]QUINOLINES AND THEIR USE AS ESTROGENIC AGENTS Wyeth, A Corporation of the State of Delaware (US) 2007-05-30 EP disclosed
EP-1789420-A2 6H-[1]BENZOPYRANO[4,3-b]QUINOLINES AND THEIR USE AS ESTROGENIC AGENTS Wyeth, A Corporation of the State of Delaware (US) 2007-05-30 EP disclosed
US-20070010544-A1 ABCA1 elevating compounds CV THERAPEUTICS, INC. 2007-01-11 US disclosed
WO-2006029146-A3 6H-[1]BENZOPYRANO[4,3-b]QUINOLINES AND THEIR USE AS ESTROGENIC AGENTS WYETH CORP (US) 2006-04-27 WO disclosed
WO-2006029146-A2 6H-[1]BENZOPYRANO[4,3-b]QUINOLINES AND THEIR USE AS ESTROGENIC AGENTS WYETH (US) 2006-03-16 WO disclosed
WO-2006029146-A2 6H-[1]BENZOPYRANO[4,3-b]QUINOLINES AND THEIR USE AS ESTROGENIC AGENTS WYETH (US) 2006-03-16 WO disclosed
US-20060052410-A1 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents WYETH (US) 2006-03-09 US disclosed
US-20060052410-A1 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents WYETH (US) 2006-03-09 US disclosed
US-20060052410-A1 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents WYETH (US) 2006-03-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070191379-A1 ABCA1 elevating compounds ABCD3, ABCB4, CETP KDM4E 4502/4885MAPT 4361/4885TP53 4391/4885
US-20080293757-A1 ABCA1 ELEVATING COMPOUNDS ABCD3, ABCB4, CETP KDM4E 4502/4885MAPT 4361/4885TP53 4391/4885
US-20070010544-A1 ABCA1 elevating compounds ABCD3, ABCB4, CETP KDM4E 4502/4885MAPT 4361/4885TP53 4391/4885
US-20230114408-A1 METHODS OF MODULATING T-CELL ACTIVATION USING ESTROGEN RECEPTOR BETA (ERB) AGONISTS ESRRG, ESR2, ESRRB KDM4E 3512/4885MAPT 4646/4885TP53 4054/4885
US-20060052410-A1 6H-[1]benzopyrano[4,3-b]quinolines and their use as estrogenic agents CYP19A1, ESR1, ESR2 KDM4E 546/4885MAPT 3973/4885TP53 1294/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.