SCHEMBL355825

SCHEMBL355825

COc1ccc2c(c1)CCC2=NO

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.57
▸ MAPT P10636 8/20 0.57
▸ RAB9A P51151 4/20 0.57
▸ NPC1 O15118 3/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57
▸ ALDH1A1 P00352 3/20 0.53
▸ NFKB1 P19838 2/20 0.53
▸ NFKB2 Q00653 2/20 0.53
▸ RELA Q04206 2/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ APP P05067 1/20 0.51
▸ SNCA P37840 1/20 0.51
▸ KDM4E B2RXH2 3/20 0.48
▸ GLA P06280 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ MPO P05164 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ ATM Q13315 1/20 0.47

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
SCHEMBL16082212 1.00 HTT (0.57) HTTMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL355824 1.00 HTT (0.57) HTTMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL11971460 0.90 MAPT (0.55) HTTMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL1806126 0.90 MAPT (0.55) HTTMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL1809661 0.90 MAPT (0.55) HTTMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL18746297 0.89 MAPT (0.53) MAPTRAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL10458884 0.89 MAPT (0.53) MAPTRAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL356454 0.86 MAPT (0.51) HTTMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL5969900 0.86 MAPT (0.51) HTTMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL356453 0.86 MAPT (0.51) HTTMAPTRAB9ANPC1SMN1; SMN2

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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110669070-A Synthesis method of O- (dialkyl phosphinic group) ketoxime 成都理工大学 2020-01-10 — — CN claimed
EP-0882016-A1 ALKYLATED STYRENES AS PRODRUGS TO COX-2 INHIBITORS MERCK FROSST CANADA INC. (CA) 1998-12-09 — — EP claimed
WO-1997028121-A1 ALKYLATED STYRENES AS PRODRUGS TO COX-2 INHIBITORS MERCK FROSST CANADA INC. (CA) 1997-08-07 — — WO claimed
EP-3398452-B1 COMESTIBLE COMPOSITIONS COMPRISING HIGH POTENCY SAVORY FLAVORANTS FIRMENICH INCORPORATED (US) 2024-10-02 — — EP disclosed
CN-110669070-B Synthesis method of O- (dialkyl phosphinic group) ketoxime 成都理工大学 2021-08-27 — — CN disclosed
CN-110669070-A Synthesis method of O- (dialkyl phosphinic group) ketoxime 成都理工大学 2020-01-10 — — CN disclosed
EP-3398452-A2 COMESTIBLE COMPOSITIONS COMPRISING HIGH POTENCY SAVORY FLAVORANTS, AND PROCESSES FOR PRODUCING THEM Senomyx, Inc. (US) 2018-11-07 — — EP disclosed
EP-3235811-B1 PROCESS OF PREPARING OXALAMIDES SENOMYX INC (US) 2018-07-25 — — EP disclosed
EP-3235811-A1 PROCESS OF PREPARING OXALAMIDES Senomyx, Inc. (US) 2017-10-25 — — EP disclosed
EP-2010009-B1 PROCESSES FOR PREPARING SOLID FLAVORANT COMPOSITIONS SENOMYX INC (US) 2017-06-14 — — EP disclosed
US-9216972-B2 Tricyclic heterocyclic compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2015-12-22 — — US disclosed
EP-1446387-A1 SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2004-08-18 — — EP disclosed
US-20030144297-A1 Substituted aryl 1,4-pyrazine derivatives PHARMACIA & UPJOHN COMPANY 2003-07-31 — — US disclosed
WO-2003045924-A1 SUBSTITUTED ARYL 1,4-PYRAZINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-06-05 — — WO disclosed
EP-0526402-B1 Heteroaryl substituted hydroxylamine derivatives as lipoxygenase inhibitors CIBA GEIGY AG (CH) 1998-01-21 — — EP disclosed
US-5350761-A Lipoxygenase inhibitors as antiinflammatory agents and antiallergens CIBA-GEIGY CORPORATION (US) 1994-09-27 — — US disclosed
US-5334600-A Lipoxygenase inhibitors CIBA-GEIGY CORPORATION (US) 1994-08-02 — — US disclosed
US-5260316-A Lipoxygenase inhibitor CIBA-GEIGY CORPORATION (US) 1993-11-09 — — US disclosed
EP-0526402-A1 Heteroaryl substituted hydroxylamine derivatives as lipoxygenase inhibitors CIBA-GEIGY AG (CH) 1993-02-03 — — EP disclosed
EP-0144235-A2 N6-(1- and 2-benzocycloalkyl) adenosines, pharmaceutical compositions comprising the same and a process for the production thereof WARNER-LAMBERT COMPANY (US) 1985-06-12 — — 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-20030144297-A1 Substituted aryl 1,4-pyrazine derivatives HTR2C, HTR4, HTR5A HTT 956/4885MAPT 2244/4885RAB9A 3006/4885

“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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