SCHEMBL15040779

SCHEMBL15040779

O=C(Cc1ccc(O)cc1)c1c(O)cc(O)cc1F

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.61
HPGD P15428 5/20 0.61
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
CYP3A4 P08684 3/20 0.61
MAPK1 P28482 2/20 0.61
PIK3CA P42336 1/20 0.61
ESR1 P03372 2/20 0.56
SHBG P04278 1/20 0.56
ESR2 Q92731 1/20 0.56
GAA P10253 6/20 0.55
PKM P14618 1/20 0.55
LMNA P02545 5/20 0.54
SLC5A1 P13866 3/20 0.54
SLC5A2 P31639 3/20 0.54
ALDH1A1 P00352 3/20 0.54
HSD17B10 Q99714 2/20 0.54
CYP19A1 P11511 2/20 0.54
ATM Q13315 2/20 0.54
KDM4E B2RXH2 1/20 0.54

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
SCHEMBL5036945 0.88 MAPT (0.77) MAPTHPGDMEN1KMT2ACYP3A4
SCHEMBL11627675 0.83 SLC5A1 (0.71) MAPTHPGDMEN1KMT2ACYP3A4
SCHEMBL5622899 0.80 MAPT (0.71) MAPTHPGDMEN1KMT2ACYP3A4
SCHEMBL13991130 0.80 LMNA (0.79) MAPTHPGDMEN1KMT2ACYP3A4
SCHEMBL5623783 0.77 NFKB1 (0.61) MAPTHPGDMEN1KMT2ACYP3A4
SCHEMBL6396380 0.76 MAPT (0.56) MAPTHPGDMEN1KMT2ACYP3A4
SCHEMBL6402624 0.76 HPGD (0.52) MAPTHPGDMEN1KMT2ACYP3A4
SCHEMBL11628971 0.76 SLC5A1 (0.71) MAPTHPGDMEN1KMT2ACYP3A4
SCHEMBL145265 0.75 LMNA (0.78) MAPTHPGDMEN1KMT2ACYP3A4
SCHEMBL1500125 0.75 CYP3A4 (0.74) MAPTHPGDMEN1KMT2ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170362210-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2017-12-21 US disclosed
US-20170362210-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2017-12-21 US disclosed
US-20170362210-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2017-12-21 US disclosed
WO-2016174551-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2016-11-03 WO disclosed
WO-2016174551-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2016-11-03 WO disclosed
US-20160311805-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2016-10-27 US disclosed
US-20160311805-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2016-10-27 US disclosed
US-20160311805-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2016-10-27 US disclosed
US-20150197506-A1 NOVEL BENZOPYRAN COMPOUNDS, COMPOSITIONS AND USES THEREOF OLEMA PHARMACEUTICALS, INC. (US) 2015-07-16 US disclosed
US-20150197506-A1 NOVEL BENZOPYRAN COMPOUNDS, COMPOSITIONS AND USES THEREOF OLEMA PHARMACEUTICALS, INC. (US) 2015-07-16 US disclosed
US-9018244-B2 Benzopyran compounds, compositions and uses thereof OLEMA PHARMACEUTICALS, INC. (US) 2015-04-28 US disclosed
US-9018244-B2 Benzopyran compounds, compositions and uses thereof OLEMA PHARMACEUTICALS, INC. (US) 2015-04-28 US disclosed
US-20130178445-A1 Novel Benzopyran Compounds, Compositions and Uses Thereof OLEMA PHARMACEUTICALS, INC. (US) 2013-07-11 US disclosed
US-20130178445-A1 Novel Benzopyran Compounds, Compositions and Uses Thereof OLEMA PHARMACEUTICALS, INC. (US) 2013-07-11 US disclosed
WO-2013090921-A1 NOVEL BENZOPYRAN COMPOUNDS, COMPOSITIONS AND USES THEREOF OLEMA PHARMACEUTICALS, INC. (US) 2013-06-20 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 (4 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-20150197506-A1 NOVEL BENZOPYRAN COMPOUNDS, COMPOSITIONS AND USES THEREOF ESR2, GPER1, ESR1 MAPT 3454/4885HPGD 1227/4885MEN1 4303/4885
US-20130178445-A1 Novel Benzopyran Compounds, Compositions and Uses Thereof ESR2, GPER1, ESR1 MAPT 3454/4885HPGD 1227/4885MEN1 4303/4885
US-20170362210-A1 ANTI-ESTROGENIC COMPOUNDS ESR1, ESRRA, ESR2 MAPT 4628/4885HPGD 2014/4885MEN1 631/4885
US-20160311805-A1 ANTI-ESTROGENIC COMPOUNDS ESR1, ESRRA, ESR2 MAPT 4628/4885HPGD 2014/4885MEN1 631/4885

“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.