SCHEMBL5129280

SCHEMBL5129280

COc1cc2c(cc1OC)CN(Cc1cccc(Cc3ccccc3)c1)CC2

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
REV1 Q9UBZ9 1/20 0.66
KDM4E B2RXH2 4/20 0.62
TDP1 Q9NUW8 1/20 0.62
KMT2A Q03164 2/20 0.62
MAPT P10636 2/20 0.60
GAA P10253 1/20 0.60
RAB9A P51151 1/20 0.60
ABCB1 P08183 8/20 0.59
ABCC1 P33527 4/20 0.59
ABCG2 Q9UNQ0 2/20 0.59
POLB P06746 1/20 0.56
ALDH1A1 P00352 2/20 0.56
ALOX15 P16050 1/20 0.56
TSHR P16473 1/20 0.56
CASP1 P29466 1/20 0.56
CASP7 P55210 1/20 0.56
HSD17B10 Q99714 1/20 0.56
HTT P42858 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
TAAR1 Q96RJ0 1/20 0.55

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
SCHEMBL5130886 0.85 REV1 (0.67) REV1KDM4ETDP1KMT2AMAPT
SCHEMBL5128393 0.84 REV1 (0.69) REV1KDM4ETDP1KMT2AMAPT
SCHEMBL5131462 0.84 KDM4E (0.71) REV1KDM4ETDP1KMT2AMAPT
SCHEMBL3050371 0.82 REV1 (0.84) REV1KDM4ETDP1KMT2AMAPT
SCHEMBL10028313 0.82 KDM4E (0.62) REV1KDM4ETDP1KMT2AMAPT
SCHEMBL3059849 0.82 REV1 (0.74) REV1KDM4ETDP1KMT2AABCB1
SCHEMBL3056974 0.82 REV1 (0.71) REV1KDM4ETDP1KMT2AMAPT
SCHEMBL3046416 0.82 REV1 (0.71) REV1KDM4ETDP1KMT2AMAPT
SCHEMBL10028336 0.81 KDM4E (0.61) REV1KDM4ETDP1KMT2AMAPT
SCHEMBL3059243 0.81 REV1 (0.78) REV1KDM4ETDP1KMT2AMAPT

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 5 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
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 2490/4885KDM4E 1758/4885TDP1 3188/4885

“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.