SCHEMBL6477394

SCHEMBL6477394

CCOC(=O)CC(=O)NCCc1cc(OC)cc(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.54
KMT2A Q03164 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
GLA P06280 1/20 0.52
CNR2 P34972 3/20 0.49
MEN1 O00255 1/20 0.45
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45

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
SCHEMBL6476422 0.87 MTNR1A (0.63) CNR1SMN1; SMN2MTNR1AMTNR1B
SCHEMBL7051374 0.86 KMT2A (0.72) KMT2ASMN1; SMN2GLAMEN1
SCHEMBL6023589 0.83 KMT2A (0.60) KMT2AMEN1
SCHEMBL11083887 0.80 CNR1 (0.57) CNR1KMT2ASMN1; SMN2GLACNR2
SCHEMBL6484083 0.80 KMT2A (0.62) KMT2ASMN1; SMN2MEN1
SCHEMBL6023129 0.79 BCHE (0.54) KMT2AMEN1
SCHEMBL63490 0.79 CYP4F2 (0.56) KMT2ASMN1; SMN2
SCHEMBL6482686 0.78 HDAC3 (0.64) KMT2ASMN1; SMN2MEN1MTNR1AMTNR1B
SCHEMBL18183526 0.77 SMN1; SMN2 (0.70) CNR1SMN1; SMN2CNR2MTNR1AMTNR1B
SCHEMBL6478319 0.77 KMT2A (0.62) KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6930114-B2 Pyrrolo (2.1a)dihydroisoquinolines and their use as phosphodiesterase 10a inhibitors BAYER PHARMACEUTICALS CORPORATION (US) 2005-08-16 US disclosed
US-20040138249-A1 Pyrrolo (2.1a)dihydroisoquinolines and their use as phosphodiesterase 10a inhibitors BAYER PHARMACEUTICALS CORPORATION 2004-07-15 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-20040138249-A1 Pyrrolo (2.1a)dihydroisoquinolines and their use as phosphodiesterase 10a inhibitors PDE7B, PDE2A, PDE5A CNR1 3290/4885KMT2A 1344/4885SMN1; SMN2 4316/4885

“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.