SCHEMBL1655655

SCHEMBL1655655

Oc1ccc(-c2cocn2)nc1

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P4HA1 P13674 1/20 0.32
P4HTM Q9NXG6 1/20 0.32
CCR1 P32246 1/20 0.32
CCR5 P51681 1/20 0.32
CCR8 P51685 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
F2RL1 P55085 1/20 0.31
SCN9A Q15858 1/20 0.31
HSD17B1 P14061 2/20 0.31
HSD17B2 P37059 2/20 0.31
HDAC4 P56524 1/20 0.31
ESR1 P03372 1/20 0.30
KDM1A O60341 1/20 0.30
FAAH O00519 1/20 0.30
CASP6 P55212 1/20 0.30

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
SCHEMBL1070654 0.80 CCR1 (0.46) P4HA1P4HTMCCR1CCR5CCR8
SCHEMBL30958843 0.80 CCR1 (0.46) P4HA1P4HTMCCR1CCR5CCR8
SCHEMBL17729305 0.76 CA12 (0.38) CCR1CCR5CCR8HDAC6SCN9A
SCHEMBL1186172 0.75 ESR1 (0.46) SCN9AHSD17B1HSD17B2HDAC4ESR1
SCHEMBL27584154 0.72 PTGER4 (0.38) CCR1CCR5CCR8HDAC6
SCHEMBL17729402 0.71 PTPN1 (0.42) P4HA1P4HTMHDAC4FAAH
SCHEMBL852125 0.71 FYN (0.46) HSD17B1HSD17B2KDM1A
SCHEMBL657438 0.71 TYR (0.43) F2RL1ESR1CASP6
SCHEMBL16159214 0.69 SCN9A (0.36) SCN9AHSD17B1HSD17B2HDAC4
SCHEMBL24302699 0.68 ALDH1A1 (0.52) P4HA1P4HTMCCR1CCR5CCR8

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-1810969-B1 ARYLOXY-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES MSD KK (JP) 2013-08-07 EP disclosed
CN-101094847-B Aryloxy-substituted benzimidazole derivatives BANYU PHARMA CO LTD 2011-06-15 CN disclosed
US-7932394-B2 1-{[5-[4-(Methylsulfonyl)phenoxy]-2-(2-pyridinyl)-1H-benzimidazol-6-yl]methyl}-5-thioxo-2-pyrrolidinone;glucokinase activator; antidiabetic agents; obesity; prevention of retinopathy, nephropathy, neurosis, ischemic cardiopathy, arteriosclerosis; antiischemic agents; cardiotonic agents MSD K.K. (JP) 2011-04-26 US disclosed
US-20080125429-A1 Aryloxy-Substituted Benzimidazole Derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-05-29 US disclosed
EP-1810969-A1 ARYLOXY-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-07-25 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-20080125429-A1 Aryloxy-Substituted Benzimidazole Derivatives GCK, GCKR, SLC5A1 P4HA1 3130/4885P4HTM 4521/4885CCR1 2431/4885

“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.