SCHEMBL15937428

SCHEMBL15937428

Cn1cnc2cc3ncsc3cc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ IP6K1 Q92551 1/20 0.43
▸ KDM4E B2RXH2 3/20 0.42
▸ ACVR1 Q04771 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ HSD17B10 Q99714 1/20 0.38
▸ EGFR P00533 1/20 0.36
▸ TGFBR1 P36897 3/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ HKDC1 Q2TB90 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ ACVR1B P36896 1/20 0.34
▸ RIPK2 O43353 1/20 0.33
▸ GRM5 P41594 1/20 0.33
▸ GRM1 Q13255 1/20 0.33

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
SCHEMBL9919101 0.77 BRD9 (0.40) L3MBTL1KDM4ETGFBR1NPC1RAB9A
SCHEMBL15680577 0.73 L3MBTL1 (0.50) L3MBTL1IP6K1KDM4EACVR1ALDH1A1
SCHEMBL21892099 0.71 L3MBTL1 (0.46) L3MBTL1IP6K1KDM4EACVR1ALDH1A1
SCHEMBL4728366 0.70 HDAC6 (0.59) L3MBTL1IP6K1KDM4EACVR1ALDH1A1
SCHEMBL4560336 0.70 ALDH1A1 (0.50) L3MBTL1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL12351357 0.69 L3MBTL1 (0.47) L3MBTL1IP6K1KDM4EACVR1ALDH1A1
SCHEMBL12342255 0.69 L3MBTL1 (0.47) L3MBTL1IP6K1KDM4EACVR1ALDH1A1
SCHEMBL18404755 0.69 PARP1 (0.46) IP6K1ALDH1A1
SCHEMBL29607244 0.68 L3MBTL1 (0.60) L3MBTL1IP6K1KDM4EACVR1ALDH1A1
SCHEMBL7600132 0.68 L3MBTL1 (0.60) L3MBTL1IP6K1KDM4EACVR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9655363-B2 Microbiocides SYNGENTA PARTICIPATIONS AG (CH) 2017-05-23 — — US disclosed
US-9655363-B2 Microbiocides SYNGENTA PARTICIPATIONS AG (CH) 2017-05-23 — — US disclosed
EP-2951167-B1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2017-01-25 — — EP disclosed
US-20150351402-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2015-12-10 — — US disclosed
US-20150351402-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2015-12-10 — — US disclosed
WO-2014118170-A1 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-08-07 — — 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-20150351402-A1 NOVEL MICROBIOCIDES MSR1, C1R, CD14 L3MBTL1 644/4885IP6K1 3379/4885KDM4E 2080/4885

“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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