SCHEMBL3396723

SCHEMBL3396723

CC(=O)N1c2ccc(N)cc2C(C)(c2ccc(O)cc2)CC1(C)C

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FSHR P23945 17/20 0.80
TSHR P16473 1/20 0.60
MEN1 O00255 1/20 0.56
ADRB2 P07550 1/20 0.56
KMT2A Q03164 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
MAPT P10636 1/20 0.46

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
SCHEMBL5727768 0.94 FSHR (0.86) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL1322857 0.89 FSHR (0.78) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL5728539 0.89 FSHR (0.78) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL1322285 0.89 FSHR (1.00) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3392106 0.87 FSHR (0.75) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3433337 0.82 FSHR (0.68) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL4600825 0.82 FSHR (0.68) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL1322362 0.82 FSHR (0.76) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3393050 0.82 FSHR (0.67) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL17209734 0.81 FSHR (0.66) FSHRTSHRMEN1ADRB2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9174940-B2 TSH receptor antagonizing tetrahydroquinoline compounds MERCK SHARP & DOHME B.V. (NL) 2015-11-03 US disclosed
US-7674909-B2 Biphenyl-4-carboxylic acid {1-acetyl-4-[4-(2-dimethylammo-ethoxy-phenyl]-2,2,4-trimethyl-1,2,3,4-tetrahydro-quinolin-6-yl}-amide; fertility regulation; follicle stimulating hormone (FSH) N.V. ORGANON (NL) 2010-03-09 US disclosed
EP-1578727-B1 TETRAHYDROQUINOLINE DERIVATIVES AND THEIR USE AS FSH RECEPTOR MODULATORS ORGANON NV (NL) 2008-04-16 EP disclosed
US-20060167047-A1 Tetrahydorquinoline derivatives and their use as fsh receptor modulators MERCK SHARP & DOHME B.V. (NL) 2006-07-27 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 (1 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-20060167047-A1 Tetrahydorquinoline derivatives and their use as fsh receptor modulators FSHR, GNRHR, LHCGR FSHR 1/4885TSHR 18/4885MEN1 1789/4885

“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.