SCHEMBL17233354

SCHEMBL17233354

CCn1ncc(-c2ccc(O)cc2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 2/20 0.43
▸ CHRM3 P20309 2/20 0.43
▸ MAPT P10636 5/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ STAT3 P40763 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ ESR1 P03372 4/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TRPM8 Q7Z2W7 1/20 0.38
▸ ESR2 Q92731 2/20 0.37
▸ ESRRA P11474 2/20 0.37
▸ ESRRB O95718 1/20 0.37
▸ FYN P06241 1/20 0.36
▸ MET P08581 2/20 0.36
▸ BCHE P06276 1/20 0.36

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
SCHEMBL18608951 0.83 CHRM2 (0.44) CHRM2CHRM3MAPTNPC1RAB9A
SCHEMBL5049416 0.81 CHRM2 (0.43) CHRM2CHRM3MAPTNPC1RAB9A
SCHEMBL14294672 0.81 CHRM2 (0.45) CHRM2CHRM3MAPTNPC1RAB9A
SCHEMBL18590273 0.79 ALDH1A1 (0.42) CHRM2CHRM3MAPTNPC1RAB9A
SCHEMBL18598425 0.77 CHRM2 (0.40) CHRM2CHRM3HSD17B10ALDH1A1TP53
SCHEMBL21412297 0.77 AOC3 (0.47) CHRM2CHRM3MAPTNPC1RAB9A
SCHEMBL7085169 0.76 MTOR (0.46) MAPTNPC1RAB9ASMN1; SMN2ESR1
SCHEMBL23718615 0.71 AOC3 (0.51) —
SCHEMBL23718611 0.71 AOC3 (0.51) —
SCHEMBL21051373 0.70 ACSS2 (0.43) MAPTNPC1RAB9ASMN1; SMN2STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3138840-B1 THIADIAZOLIDINE DERIVATIVE AS ANTI-ENTEROVIRUS 71 JIANGSU KANION PHARMACEUTICAL CO LTD (CN) 2020-09-23 — — EP disclosed
CN-106661009-B Anti- enteric virus71 thiadiazolidine derivative 江苏康缘药业股份有限公司 2019-11-26 — — CN disclosed
US-9988361-B2 Anti-enterovirus 71 thiadiazolidine derivative JIANGSU KANION PHARMACEUTICAL CO., LTD. (CN) 2018-06-05 — — US disclosed
US-9988361-B2 Anti-enterovirus 71 thiadiazolidine derivative JIANGSU KANION PHARMACEUTICAL CO., LTD. (CN) 2018-06-05 — — US disclosed
US-9988361-B2 Anti-enterovirus 71 thiadiazolidine derivative JIANGSU KANION PHARMACEUTICAL CO., LTD. (CN) 2018-06-05 — — US disclosed
US-20170066732-A1 ANTI-ENTEROVIRUS 71 THIADIAZOLIDINE DERIVATIVE Jiangsu Kanion pharmaceutical CO. LTD (CN) 2017-03-09 — — US disclosed
US-20170066732-A1 ANTI-ENTEROVIRUS 71 THIADIAZOLIDINE DERIVATIVE Jiangsu Kanion pharmaceutical CO. LTD (CN) 2017-03-09 — — US disclosed
US-20170066732-A1 ANTI-ENTEROVIRUS 71 THIADIAZOLIDINE DERIVATIVE Jiangsu Kanion pharmaceutical CO. LTD (CN) 2017-03-09 — — US disclosed
EP-3138840-A1 ANTI-ENTEROVIRUS 71 THIADIAZOLIDINE DERIVATIVE Jiangsu Kanion Pharmaceutical Co., Ltd. (CN) 2017-03-08 — — EP disclosed
CN-105085512-A Enteric virus 71 (EV71)-resistant thiadiazolidine derivatives NANJING MINGDE NEW DRUG RES AND DEV CO LTD 2015-11-25 — — CN disclosed
WO-2015165340-A1 ANTI-ENTEROVIRUS 71 THIADIAZOLIDINE DERIVATIVE 南京明德新药研发股份有限公司 2015-11-05 — — 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 (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-20170066732-A1 ANTI-ENTEROVIRUS 71 THIADIAZOLIDINE DERIVATIVE EIF2AK2, GTF3C5, GTF3C1 CHRM2 4846/4885CHRM3 4827/4885MAPT 3673/4885

“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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