SCHEMBL6086065

SCHEMBL6086065

CCOC(=O)c1ccc(Nc2cc3c(cc2OCc2ccccc2)C(C)(C)CC=C3C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPIA P62937 2/20 0.46
MAPT P10636 5/20 0.42
NAMPT P43490 1/20 0.42
RAB9A P51151 3/20 0.41
THRB P10828 3/20 0.40
POLB P06746 1/20 0.40
CTSV O60911 1/20 0.40
CTSL P07711 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
NPC1 O15118 2/20 0.39
GAA P10253 2/20 0.39
GBA1 P04062 1/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
APAF1 O14727 1/20 0.39
MITF O75030 1/20 0.39

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
SCHEMBL6086081 0.90 PPIA (0.43) PPIAMAPTNAMPTRAB9ATHRB
SCHEMBL6086057 0.90 PPIA (0.43) PPIAMAPTNAMPTRAB9ATHRB
SCHEMBL6085692 0.85 TSHR (0.41) MAPTRAB9ATHRBSMN1; SMN2KMT2A
SCHEMBL6086142 0.85 TSHR (0.41) MAPTRAB9ATHRBSMN1; SMN2KMT2A
SCHEMBL6086027 0.85 PPIA (0.43) PPIAMAPTNAMPTRAB9ATHRB
SCHEMBL6086033 0.85 PPIA (0.43) PPIAMAPTNAMPTRAB9ATHRB
SCHEMBL6085542 0.83 HPGD (0.41) PPIAMAPTRAB9ATHRBSMN1; SMN2
SCHEMBL6088130 0.81 MEN1 (0.45) MAPTRAB9ATHRBSMN1; SMN2KMT2A
SCHEMBL6086018 0.81 RXRA (0.41) PPIAMAPTNAMPTRAB9ASMN1; SMN2
SCHEMBL6087328 0.80 KDM4E (0.36) PPIAMAPTRAB9ATHRBSMN1; SMN2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7026487-B2 Amines substituted with a dihydronaphthalenyl, chromenyl, or thiochromenyl group, a pyridyl group and an alkyl group, having retinoid-like biological activity ALLERGAN, INC. (US) 2006-04-11 US disclosed
US-20040097733-A1 Amines substituted with a dihydronaphthalenyl, chromenyl, or thiochromenyl group, an aryl or heteroaryl group and an alkyl group, having retinoid-like biological activity BEARD RICHARD L (US) 2004-05-20 US disclosed
US-20030166932-A1 Amines substituted with a dihydronaphthalenyl, chromenyl, or thiochromenyl group, an aryl or heteroaryl group and an alkyl group, having retinoid-like biological activity ALLERGAN SALES, INC. 2003-09-04 US disclosed
US-6613917-B1 Retinoid agonist, antagonist or negative hormone-like biological activity ALLERGAN, INC. 2003-09-02 US disclosed
EP-1265848-A2 AMINES SUBSTITUTED WITH A DIHYDRONAPHTHALENYL, CRHOMENYL, OR THIOCHROMENYL GROUP, AN ARYL OR HETEROARYL GROUP AND AN ALKYL GROUP, HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY Allergan Sales, Inc. (US) 2002-12-18 EP disclosed
WO-2001070668-A2 AMINES SUBSTITUTED WITH A DIHYDRONAPHTHALENYL, CRHOMENYL, OR THIOCHROMENYL GROUP, AN ARYL OR HETEROARYL GROUP AND AN ALKYL GROUP, HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY ALLERGAN, INC. (US) 2001-09-27 WO 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 (2 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-20030166932-A1 Amines substituted with a dihydronaphthalenyl, chromenyl, or thiochromenyl group, an aryl or heteroaryl group and an alkyl group, having retinoid-like biological activity NR4A1, NR2E3, NR0B1 PPIA 4765/4885MAPT 3421/4885NAMPT 1325/4885
US-20040097733-A1 Amines substituted with a dihydronaphthalenyl, chromenyl, or thiochromenyl group, an aryl or heteroaryl group and an alkyl group, having retinoid-like biological activity NR4A1, NR2E3, NR0B1 PPIA 4765/4885MAPT 3421/4885NAMPT 1325/4885

“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.