SCHEMBL4424160

SCHEMBL4424160

COc1cc2c(c(OC)c1)C(c1ccc(O)cc1)N(C(=O)c1cnc3ccccc3n1)CC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2C Q14957 3/20 0.47
MTNR1B P49286 1/20 0.44
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
ABCB1 P08183 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PTK2 Q05397 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 2/20 0.39
CA9 Q16790 2/20 0.39
CA14 Q9ULX7 2/20 0.39
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL4412944 0.90 GRIN2C (0.46) GRIN2CMTNR1BHCRTR1HCRTR2ABCB1
SCHEMBL4423136 0.85 GRIN2C (0.42) GRIN2CMTNR1BHCRTR1HCRTR2ABCB1
SCHEMBL4422963 0.79 GRIN2C (0.47) GRIN2CMTNR1BABCG2MEN1KMT2A
SCHEMBL4414980 0.79 KMT2A (0.60) GRIN2CMTNR1BABCB1ABCG2MEN1
SCHEMBL4423052 0.79 GRIN2C (0.57) GRIN2CMTNR1BMEN1KMT2ACA12
SCHEMBL4423041 0.79 GRIN2C (0.54) GRIN2CMTNR1BABCG2MEN1KMT2A
SCHEMBL13972856 0.77 GRIN2C (0.53) GRIN2CMTNR1BMEN1KMT2AHPGD
SCHEMBL6505155 0.77 GRIN2C (0.53) GRIN2CMTNR1BMEN1KMT2AHPGD
SCHEMBL4413283 0.77 MTNR1B (0.46) GRIN2CMTNR1BMEN1KMT2ATRPV1
SCHEMBL4425728 0.76 GRIN2C (0.43) GRIN2CMTNR1BMEN1KMT2ATRPV1

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
EP-1663983-B1 N-SUBSTITUTED, 6,8-DIALKOXY-1,2,3,4-TETRAHYDRO-1H-ISOQUINOLINE AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2009-01-21 EP disclosed
EP-1663983-A1 N-SUBSTITUTED, 6,8-DIALKOXY-1,2,3,4-TETRAHYDRO-1H-ISOQUINOLINE AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2006-06-07 EP disclosed
US-20050070570-A1 Novel potassium channels modulators 4SC AG (DE) 2005-03-31 US disclosed
WO-2004113302-A1 N-SUBSTITUTED 6,8-DIALKOXY-1,2,3,4-TETRAHYDRO-1H-ISOQUINOLINE AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2004-12-29 WO disclosed
EP-1489071-A1 N-substituted, 3,4-dihydro-1H-isoquinoline as potassium channels modulators 4SC AG (DE) 2004-12-22 EP 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-20050070570-A1 Novel potassium channels modulators HCN4, KCNA4, KCNN4 GRIN2C 567/4885MTNR1B 569/4885HCRTR1 281/4885

“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.