SCHEMBL3394512

SCHEMBL3394512

CC(=O)N1c2ccc(N)cc2C(C)(c2ccc(OCCN3CCCCCC3)cc2)CC1(C)C

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FSHR P23945 8/20 0.61
TSHR P16473 1/20 0.47
LTA4H P09960 2/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 1/20 0.43
ADRB2 P07550 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
PSMB1 P20618 3/20 0.43
PSMB5 P28074 3/20 0.43
PSMB2 P49721 2/20 0.43
ALDH1A1 P00352 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HRH3 Q9Y5N1 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
SCHEMBL3394787 0.91 FSHR (0.59) FSHRTSHRKDM4EMEN1ADRB2
SCHEMBL3398202 0.91 FSHR (0.59) FSHRTSHRKDM4EMEN1ADRB2
SCHEMBL3397839 0.87 FSHR (0.58) FSHRTSHRKDM4EMEN1ADRB2
SCHEMBL3433337 0.87 FSHR (0.68) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3393050 0.86 FSHR (0.67) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3393047 0.85 FSHR (0.66) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3396813 0.84 FSHR (0.64) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL4600825 0.83 FSHR (0.68) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3396323 0.82 FSHR (0.59) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3393025 0.82 FSHR (0.61) 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 1/4885TSHR 18/4885LTA4H 2283/4885

“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.