SCHEMBL3394787

SCHEMBL3394787

CC(=O)N1c2ccc(N)cc2C(C)(c2ccc(OCCN3CCOCC3)cc2)CC1(C)C

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FSHR P23945 9/20 0.59
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 1/20 0.42
ADRB2 P07550 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41

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
SCHEMBL3397839 0.96 FSHR (0.58) FSHRKDM4EALDH1A1TSHRMEN1
SCHEMBL3394512 0.91 FSHR (0.61) FSHRKDM4EALDH1A1TSHRMEN1
SCHEMBL3398202 0.90 FSHR (0.59) FSHRKDM4EALDH1A1TSHRMEN1
SCHEMBL3394327 0.86 FSHR (0.59) FSHRKDM4EALDH1A1TSHRGAA
SCHEMBL3433337 0.85 FSHR (0.68) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3393050 0.84 FSHR (0.67) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3393357 0.84 FSHR (0.56) FSHRKDM4EALDH1A1
SCHEMBL3393047 0.83 FSHR (0.66) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3394823 0.83 FSHR (0.65) FSHRALDH1A1SMN1; SMN2
SCHEMBL3396813 0.83 FSHR (0.64) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1/4885KDM4E 445/4885ALDH1A1 2019/4885

“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.