SCHEMBL5131372

SCHEMBL5131372

Cc1cc(C(C)N2CCc3ccccc3C2)cc(C)c1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.51
OGA O60502 1/20 0.47
CHRNA7 P36544 2/20 0.42
PRMT5 O14744 5/20 0.42
WDR77 Q9BQA1 5/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
S1PR1 P21453 1/20 0.39
S1PR5 Q9H228 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
SCHEMBL5130930 0.88 CHRNA7 (0.56) HRH3CHRNA7KDM4EALDH1A1TSHR
SCHEMBL5128246 0.82 HRH3 (0.60) HRH3OGAPRMT5WDR77L3MBTL1
SCHEMBL5128317 0.81 HRH3 (0.60) HRH3OGAPRMT5WDR77L3MBTL1
SCHEMBL19266658 0.80 HRH3 (0.54) HRH3OGAPRMT5WDR77L3MBTL1
SCHEMBL14199939 0.74 GLRA1 (0.49) L3MBTL1ALDH1A1MAPTTSHR
SCHEMBL30509641 0.72 HRH3 (0.50) HRH3PRMT5WDR77MEN1KMT2A
SCHEMBL5130916 0.72 REV1 (0.65) HRH3CHRNA7KMT2AS1PR1S1PR5
SCHEMBL21171660 0.71 FFAR1 (0.55) HRH3PRMT5WDR77MEN1KMT2A
SCHEMBL5131480 0.70 REV1 (0.57) HRH3CHRNA7KDM4EALDH1A1TSHR
SCHEMBL5128313 0.70 OGA (0.55) HRH3OGAPRMT5WDR77KDM4E

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-20080161344-A1 Melanin Concentrating Hormone Receptor Ligands: Substituted Tetrahydroisoquinoline Analogues NEUROGEN CORPORATION 2008-07-03 US claimed
US-20080161344-A1 Melanin Concentrating Hormone Receptor Ligands: Substituted Tetrahydroisoquinoline Analogues NEUROGEN CORPORATION 2008-07-03 US disclosed
US-20080161344-A1 Melanin Concentrating Hormone Receptor Ligands: Substituted Tetrahydroisoquinoline Analogues NEUROGEN CORPORATION 2008-07-03 US disclosed
US-20080161344-A1 Melanin Concentrating Hormone Receptor Ligands: Substituted Tetrahydroisoquinoline Analogues NEUROGEN CORPORATION 2008-07-03 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-20080161344-A1 Melanin Concentrating Hormone Receptor Ligands: Substituted Tetrahydroisoquinoline Analogues MCHR1, MCHR2, MC1R HRH3 88/4885OGA 4569/4885CHRNA7 427/4885

“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.