SCHEMBL8486452

SCHEMBL8486452

CCOC(=O)c1cc2n(c1)CCc1cc(OC)c(OC)cc1-2

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 2/20 0.57
▸ KMT2A Q03164 3/20 0.42
▸ MAPT P10636 5/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KDM4E B2RXH2 5/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ HPGD P15428 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.41
▸ HSD17B2 P37059 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.40
▸ PDE4D Q08499 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ GPR84 Q9NQS5 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
SCHEMBL14812851 0.93 KCNK3 (0.50) KCNK3KMT2AMAPTMEN1KDM4E
SCHEMBL18932675 0.92 KCNK3 (0.48) KCNK3KMT2AMAPTMEN1KDM4E
SCHEMBL14811913 0.92 KCNK3 (0.48) KCNK3KMT2AMAPTKDM4EALDH1A1
SCHEMBL14813035 0.92 KCNK3 (0.48) KCNK3KMT2AMAPTKDM4EALDH1A1
SCHEMBL14812701 0.92 KCNK3 (0.48) KCNK3KMT2AMAPTMEN1KDM4E
SCHEMBL14813041 0.88 KCNK3 (0.45) KCNK3KMT2AMAPTKDM4EALDH1A1
SCHEMBL14812728 0.87 KCNK3 (0.43) KCNK3KMT2AMAPTMEN1KDM4E
SCHEMBL18932931 0.85 CA12 (0.43) KCNK3KMT2AMAPTMEN1KDM4E
SCHEMBL14811446 0.84 KCNK3 (0.44) KCNK3KMT2AKDM4EALDH1A1HPGD
SCHEMBL8487213 0.84 MEN1 (0.49) KCNK3KMT2AMAPTMEN1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10155259-B2 FSH receptor antagonists MERCK SHARP & DOHME B.V. (NL) 2018-12-18 — — US disclosed
EP-2763986-B1 FSH RECEPTOR ANTAGONISTS MERCK SHARP & DOHME (NL) 2017-06-07 — — EP disclosed
EP-2763986-B1 FSH RECEPTOR ANTAGONISTS MERCK SHARP & DOHME (NL) 2017-06-07 — — EP disclosed
US-20150329545-A1 FSH RECEPTOR ANTAGONISTS MERCK SHARP & DOHME B.V. (NL) 2015-11-19 — — US disclosed
US-20150329545-A1 FSH RECEPTOR ANTAGONISTS MERCK SHARP & DOHME B.V. (NL) 2015-11-19 — — US disclosed
US-20150329545-A1 FSH RECEPTOR ANTAGONISTS MERCK SHARP & DOHME B.V. (NL) 2015-11-19 — — US disclosed
US-9127007-B2 FSH receptor antagonists MERCK SHARP & DOHME B.V. (NL) 2015-09-08 — — US disclosed
US-9127007-B2 FSH receptor antagonists MERCK SHARP & DOHME B.V. (NL) 2015-09-08 — — US disclosed
US-9127007-B2 FSH receptor antagonists MERCK SHARP & DOHME B.V. (NL) 2015-09-08 — — US disclosed
US-20140350043-A1 FSH RECEPTOR ANTAGONISTS MERCK SHARP & DOHME B.V. (NL) 2014-11-27 — — US disclosed
US-20140350043-A1 FSH RECEPTOR ANTAGONISTS MERCK SHARP & DOHME B.V. (NL) 2014-11-27 — — US disclosed
US-20140350043-A1 FSH RECEPTOR ANTAGONISTS MERCK SHARP & DOHME B.V. (NL) 2014-11-27 — — US disclosed
EP-2763986-A1 FSH RECEPTOR ANTAGONISTS Merck Sharp & Dohme B.V. (NL) 2014-08-13 — — EP disclosed
WO-2013041458-A1 FSH RECEPTOR ANTAGONISTS MSD OSS B.V. (NL) 2013-03-28 — — WO disclosed
WO-2013041458-A1 FSH RECEPTOR ANTAGONISTS MSD OSS B.V. (NL) 2013-03-28 — — WO disclosed
US-5965575-A N-aryl piperidine compounds as 5HT1B antagonists ADIR ET COMPAGNIE (FR) 1999-10-12 — — 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 (3 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-20140350043-A1 FSH RECEPTOR ANTAGONISTS FSHR, GNRHR, LHCGR KCNK3 902/4885KMT2A 931/4885MAPT 4483/4885
US-10155259-B2 FSH receptor antagonists FSHR, GNRHR, LHCGR KCNK3 1027/4885KMT2A 920/4885MAPT 4640/4885
US-20150329545-A1 FSH RECEPTOR ANTAGONISTS FSHR, GNRHR, LHCGR KCNK3 1027/4885KMT2A 920/4885MAPT 4640/4885

“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.

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