SCHEMBL23636201

SCHEMBL23636201

Fc1ccc(Oc2ccc3nc[nH]c3c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.60
QPCT Q16769 6/20 0.51
CDK1 P06493 2/20 0.51
POLB P06746 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PSMD11 O00231 1/20 0.49
PRKCI P41743 1/20 0.47
PARP1 P09874 1/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
RAD52 P43351 1/20 0.46
CYP3A4 P08684 1/20 0.42
NAMPT P43490 1/20 0.42
XDH P47989 1/20 0.42
ALOX5AP P20292 1/20 0.42
FEN1 P39748 1/20 0.42
QPCTL Q9NXS2 1/20 0.42

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
SCHEMBL30467970 1.00 MMP12 (0.60) MMP12QPCTCDK1POLBHTT
SCHEMBL29488199 0.87 TRPA1 (0.44) MMP12QPCTCDK1POLBHTT
SCHEMBL1799380 0.85 MMP12 (0.62) MMP12QPCTCDK1HTTSMN1; SMN2
SCHEMBL29770425 0.85 MMP12 (0.62) MMP12QPCTCDK1HTTSMN1; SMN2
SCHEMBL7013293 0.83 PRKCI (0.66) MMP12QPCTCDK1SMN1; SMN2PRKCI
SCHEMBL30468011 0.83 MMP12 (0.60) MMP12QPCTCDK1POLBPRKCI
SCHEMBL23636200 0.83 MMP12 (0.60) MMP12QPCTCDK1POLBPRKCI
SCHEMBL23636198 0.83 MMP12 (0.55) MMP12QPCTCDK1PRKCIKDM4E
SCHEMBL30468089 0.83 MMP12 (0.55) MMP12QPCTCDK1PRKCIKDM4E
SCHEMBL12633977 0.83 LTA4H (0.58) MMP12QPCTCDK1KDM4ECYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110612289-B Deuterated benzimidazole compound and medical application thereof 住友制药株式会社 2023-06-30 CN disclosed
US-11066372-B2 Deuterated benzimidazole compound and medical use thereof SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2021-07-20 US disclosed
US-11066372-B2 Deuterated benzimidazole compound and medical use thereof SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2021-07-20 US disclosed
CN-110612289-A Deuterated benzimidazole compounds and medical application thereof 大日本住友制药株式会社 2019-12-24 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-11066372-B2 Deuterated benzimidazole compound and medical use thereof HCN4, HCN3, SCN8A MMP12 3736/4885QPCT 2835/4885CDK1 827/4885

“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.