SCHEMBL5127723

SCHEMBL5127723

CCOc1cc2c(cc1OC)CN(Cc1cccc(Oc3ccc(C(C)(C)C)cc3)c1)CC2

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
REV1 Q9UBZ9 1/20 0.54
ABCB1 P08183 12/20 0.51
ABCC1 P33527 4/20 0.51
KDM4E B2RXH2 2/20 0.51
ABCG2 Q9UNQ0 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
KMT2A Q03164 1/20 0.47
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.46
FAAH O00519 1/20 0.46
DHCR7 Q9UBM7 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
SCHEMBL5125860 1.00 REV1 (0.54) REV1ABCB1ABCC1KDM4EABCG2
SCHEMBL5128254 0.96 FAAH (0.48) REV1ABCB1ABCC1KDM4EABCG2
SCHEMBL5131977 0.94 REV1 (0.57) REV1ABCB1ABCC1KDM4EABCG2
SCHEMBL5125747 0.89 REV1 (0.64) REV1ABCB1ABCC1KDM4EABCG2
SCHEMBL5131159 0.85 REV1 (0.56) REV1ABCB1ABCC1KDM4EABCG2
SCHEMBL5128393 0.85 REV1 (0.69) REV1ABCB1ABCC1KDM4EABCG2
SCHEMBL5125365 0.85 ABCB1 (0.69) REV1ABCB1ABCC1KDM4EABCG2
SCHEMBL5131895 0.84 SIGMAR1 (0.58) ABCB1ABCC1KDM4EABCG2MAPT
SCHEMBL5130886 0.84 REV1 (0.67) REV1ABCB1ABCC1KDM4EABCG2
SCHEMBL5128244 0.83 FAAH (0.51) REV1ABCB1ABCC1KDM4EABCG2

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
WO-2005077903-A2 MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED TETRAHYDROISOQUINOLINE ANALOGUES NEUROGEN CORPORATION (US) 2005-08-25 WO 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 REV1 2490/4885ABCB1 2755/4885ABCC1 4549/4885

“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.