SCHEMBL3525641

SCHEMBL3525641

CC(=O)N1c2cc(NCC(C)C)c(N)cc2C(C)(c2ccccc2)CC1(C)C

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FSHR P23945 16/20 0.60
TSHR P16473 1/20 0.55
MEN1 O00255 1/20 0.55
ADRB2 P07550 1/20 0.55
KMT2A Q03164 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
TP53 P04637 2/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL3523822 0.89 FSHR (0.63) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3520023 0.87 FSHR (0.61) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3520791 0.87 FSHR (0.61) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3526409 0.83 FSHR (0.56) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3524673 0.81 FSHR (0.58) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3523782 0.81 FSHR (0.53) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3527545 0.80 FSHR (0.71) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL1322387 0.80 FSHR (0.71) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL3522272 0.77 FSHR (0.73) FSHRTSHRMEN1ADRB2KMT2A
SCHEMBL2193697 0.77 FSHR (0.67) 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-7858794-B2 Tetrahydroquinoline derivatives N.V. ORGANON (NL) 2010-12-28 US disclosed
EP-1578726-B1 TETRAHYDROQUINOLINE DERIVATIVES ORGANON NV (NL) 2009-02-25 EP disclosed
US-20060142334-A1 Tetrahydroquinoline derivatives MERCK SHARP & DOHME B.V. (NL) 2006-06-29 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-20060142334-A1 Tetrahydroquinoline derivatives GNRHR, KCNH3, HCAR3 FSHR 9/4885TSHR 628/4885MEN1 2286/4885

“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.