SCHEMBL6375210

SCHEMBL6375210

COc1ccc(CCNC(=O)CCc2ccccc2)cc1OC

nearest known ligand 0.81

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.81
MEN1 O00255 3/20 0.81
PLAAT3 P53816 1/20 0.72
PLAAT5 Q96KN8 1/20 0.72
PLAAT2 Q9NWW9 1/20 0.72
PLAAT4 Q9UL19 1/20 0.72
ALDH1A1 P00352 4/20 0.69
LMNA P02545 1/20 0.66
MAPT P10636 1/20 0.65
HTT P42858 1/20 0.65
NPC1 O15118 1/20 0.64
RAB9A P51151 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64

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
SCHEMBL7278495 0.94 PLAAT3 (0.74) KMT2AMEN1PLAAT3PLAAT5PLAAT2
SCHEMBL4022887 0.93 KMT2A (0.87) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL4026595 0.92 PLAAT3 (0.80) KMT2AMEN1PLAAT3PLAAT5PLAAT2
SCHEMBL17117415 0.91 PLAAT3 (0.74) KMT2AMEN1PLAAT3PLAAT5PLAAT2
SCHEMBL10436226 0.90 PLAAT3 (0.73) KMT2AMEN1PLAAT3PLAAT5PLAAT2
SCHEMBL9311815 0.89 KMT2A (0.72) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL4024309 0.89 KMT2A (0.80) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL4023394 0.88 KMT2A (0.79) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL8828335 0.88 KMT2A (0.64) KMT2AMEN1PLAAT3PLAAT5PLAAT2
SCHEMBL10452171 0.88 KMT2A (0.64) KMT2AMEN1PLAAT3PLAAT5PLAAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3209639-B1 COMPOUNDS AS ANTI-MALARIALS AND THEIR PROCESS OF PREPARATION COUNCIL SCIENT IND RES (IN) 2020-09-16 EP disclosed
CN-100393703-C 1,2,3,4-tetrahydroisoquinoline derivatives ACTELION PHARMACEUTICALS LTD (CH) 2008-06-11 CN disclosed
EP-1274687-B1 1,2,3,4- TETRAHYDROISOQUINOLINE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2005-01-05 EP disclosed
US-6703392-B2 OREXIN RECEPTOR ANTAGONISTS FOR OBESITY OR SLEEPING DISORDER TREATMENT ACTELION PHARMACEUTICALS LTD. (CH) 2004-03-09 US disclosed
US-20030176415-A1 1,2,3,4-tetrahydroisoquinoline derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2003-09-18 US disclosed
CN-1416420-A 1,2,3, 4-tetrahydroisoquinoline derivatives ACTELION PHARMACEUTICALS LTD (CH) 2003-05-07 CN disclosed
EP-1274687-A1 1,2,3,4- TETRAHYDROISOQUINOLINE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2003-01-15 EP disclosed
WO-2001068609-A1 1,2,3,4-TETRAHYDROISOQUINOLINE DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2001-09-20 WO 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-20030176415-A1 1,2,3,4-tetrahydroisoquinoline derivatives HCRTR2, HCRTR1, NPY2R KMT2A 1396/4885MEN1 764/4885PLAAT3 2201/4885

“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.