SCHEMBL6283959

SCHEMBL6283959

NOCC(=O)N1CCN(c2ccccc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 3/20 0.67
▸ MAPT P10636 6/20 0.64
▸ NPSR1 Q6W5P4 3/20 0.64
▸ LMNA P02545 2/20 0.64
▸ ALDH1A1 P00352 7/20 0.62
▸ ME2 P23368 1/20 0.59
▸ ME1 P48163 1/20 0.59
▸ ME3 Q16798 1/20 0.59
▸ KDM4E B2RXH2 2/20 0.59
▸ HSD17B10 Q99714 2/20 0.59
▸ HTT P42858 1/20 0.59
▸ HTR1A P08908 1/20 0.59
▸ HTR7 P34969 1/20 0.59
▸ TP53 P04637 1/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ HPGD P15428 1/20 0.57
▸ NPC1 O15118 1/20 0.57
▸ RAB9A P51151 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ CYP1A2 P05177 1/20 0.56

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
SCHEMBL8245954 0.81 MAPT (0.70) GRM5MAPTNPSR1LMNAALDH1A1
SCHEMBL9125887 0.81 GRM5 (0.72) GRM5MAPTNPSR1LMNAALDH1A1
SCHEMBL30528252 0.81 MAPT (0.86) MAPTNPSR1LMNAALDH1A1ME2
SCHEMBL1902638 0.80 GRM5 (1.00) GRM5MAPTNPSR1LMNAALDH1A1
SCHEMBL28135156 0.80 MAPT (0.78) MAPTNPSR1LMNAALDH1A1ME2
SCHEMBL7840682 0.80 MAPT (0.72) GRM5MAPTNPSR1LMNAALDH1A1
SCHEMBL5245371 0.78 MAPT (0.70) GRM5MAPTNPSR1LMNAALDH1A1
SCHEMBL17834330 0.78 MAPT (0.70) GRM5MAPTNPSR1LMNAALDH1A1
SCHEMBL3299369 0.78 MAPT (0.70) GRM5MAPTNPSR1LMNAALDH1A1
SCHEMBL12781874 0.78 MAPT (0.70) GRM5MAPTNPSR1LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016087603-A1 PROCESS FOR PREPARING A MODIFIED NATURAL RUBBER BY MEANS OF A MODIFIER COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2016-06-09 — — WO claimed
WO-2016087603-A1 PROCESS FOR PREPARING A MODIFIED NATURAL RUBBER BY MEANS OF A MODIFIER COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2016-06-09 — — WO disclosed
US-6969729-B2 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S (DK) 2005-11-29 — — US disclosed
US-6906046-B2 Pharmaceutical uses and synthesis of benzobicyclooctanes CELLTECH R & D INC. (US) 2005-06-14 — — US disclosed
EP-1135123-B1 USE OF ISATIN DERIVATIVES AS ION CHANNEL ACTIVATING AGENTS NEUROSEARCH AS (DK) 2004-12-29 — — EP disclosed
US-20030114513-A1 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S 2003-06-19 — — US disclosed
US-20030069305-A1 Pharmaceutical uses and synthesis of benzobicyclooctanes CELLTECH R & D, INC. 2003-04-10 — — US disclosed
US-20020016354-A1 Use of isatin derivatives as ion channel activating agents NEUROSEARCH A/S (DK) 2002-02-07 — — US disclosed
EP-1135123-A1 USE OF ISATIN DERIVATIVES AS ION CHANNEL ACTIVATING AGENTS NEUROSEARCH A/S (DK) 2001-09-26 — — EP disclosed
WO-2000033834-A1 USE OF ISATIN DERIVATIVES AS ION CHANNEL ACTIVATING AGENTS NEUROSEARCH A/S (DK) 2000-06-15 — — 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 (3 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-20030069305-A1 Pharmaceutical uses and synthesis of benzobicyclooctanes CXCL8, CASP8, IL18 GRM5 3276/4885MAPT 2701/4885NPSR1 1302/4885
US-20030114513-A1 Use of isatin derivatives as ion channel activating agents KCNN3, KCNJ2, KCND2 GRM5 1121/4885MAPT 1939/4885NPSR1 1265/4885
US-20020016354-A1 Use of isatin derivatives as ion channel activating agents KCNN3, KCNJ2, KCND2 GRM5 819/4885MAPT 1634/4885NPSR1 1258/4885

“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.

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