SCHEMBL6160873

SCHEMBL6160873

NCc1ccc(Oc2ccccc2)nc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 3/20 0.58
LOX P28300 2/20 0.57
MPO P05164 1/20 0.48
OPRM1 P35372 7/20 0.48
OPRD1 P41143 6/20 0.48
OPRK1 P41145 6/20 0.48
LTA4H P09960 1/20 0.45
BCAT2 O15382 1/20 0.44
GRN P28799 1/20 0.44
SORT1 Q99523 1/20 0.44
MAOB P27338 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
ACACB O00763 1/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43
GRIN1 Q05586 1/20 0.43
KCNH2 Q12809 1/20 0.43

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
Hydrochloric Acid SCHEMBL5010402 0.98 LOXL2 (0.59) LOXL2LOXMPOOPRM1OPRD1
SCHEMBL20771833 0.83 MAOB (0.51) LOXL2LOXMAOBALDH1A1HTT
SCHEMBL4380974 0.83 MEN1 (0.63) LOXL2OPRM1OPRD1OPRK1MAOB
SCHEMBL6162263 0.83 RAB9A (0.48) LOXL2LOXOPRM1OPRD1OPRK1
SCHEMBL9045204 0.83 MAOB (0.53) LOXL2LTA4HMAOBHTT
SCHEMBL8541822 0.83 KDM4E (0.58) LOXL2LOXOPRM1OPRD1OPRK1
SCHEMBL30744447 0.83 MEN1 (0.63) LOXL2OPRM1OPRD1OPRK1MAOB
SCHEMBL8309377 0.82 AGXT (0.49) LOXL2LOXMPOOPRM1OPRD1
SCHEMBL4536002 0.82 LTA4H (0.45) LOXL2LOXMPOOPRM1OPRD1
SCHEMBL510046 0.82 LTA4H (0.58) LOXL2MPOOPRM1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2810944-A1 HETEROCYCLIC COMPOUND HAVING ANTI-HIV ACTIVITY Toyama Chemical Co., Ltd. (JP) 2014-12-10 EP disclosed
CN-1474803-B Amide derivatives and their use for the preparation of medicaments MITSUBISHI TANABE PHARMA CORP 2012-11-21 CN disclosed
WO-2011131135-A1 HETEROARYL (ALKYL) DITHIOCARBAMATE COMPOUNDS, PREPARATION METHODS AND USES THEREOF 北京大学 (CN) 2011-10-27 WO disclosed
CN-102050758-A Novel amide derivatives and medicinal use thereof MITSUBISHI TANABE PHARMA CORP 2011-05-11 CN disclosed
US-20050165064-A1 Novel thiol derivative, process for producing the same and use thereof TAKEDA PHARMACEUTICALS NORTH AMERICA, INC. 2005-07-28 US disclosed
EP-1500658-A1 NOVEL THIOL DERIVATIVE, PROCESS FOR PRODUCING THE SAME AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2005-01-26 EP disclosed
CN-1474803-A Novel amide derivative and medical use thereof ������ҩ��ʽ���� 2004-02-11 CN 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-20050165064-A1 Novel thiol derivative, process for producing the same and use thereof TST, QSOX1, MMP1 LOXL2 1261/4885LOX 418/4885MPO 414/4885

“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.