SCHEMBL1065240

SCHEMBL1065240

Cc1ccc(-c2nnc(S)n2N)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.47
KMT2A Q03164 3/20 0.47
NPC1 O15118 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 5/20 0.41
PTGS2 P35354 2/20 0.37
KDM4E B2RXH2 2/20 0.37
TSHR P16473 2/20 0.37
ALOX15 P16050 1/20 0.37
GAA P10253 1/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 2/20 0.36
CYP2C19 P33261 2/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 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
SCHEMBL4349728 0.82 KMT2A (0.45) HPGDKMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL16675457 0.82 KMT2A (0.45) HPGDKMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL19328339 0.82 KMT2A (0.45) HPGDKMT2ANPC1RAB9AMAPT
SCHEMBL29315637 0.82 KMT2A (0.45) HPGDKMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL28999622 0.82 TP53 (0.51) HPGDKMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL13828022 0.82 MAPT (0.52) HPGDNPC1RAB9AMAPTALDH1A1
SCHEMBL3352182 0.82 KMT2A (0.72) HPGDKMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL1164883 0.80 KMT2A (0.47) HPGDKMT2ANPC1RAB9AMAPT
SCHEMBL28578532 0.79 KMT2A (0.49) HPGDKMT2ANPC1SMN1; SMN2RAB9A
SCHEMBL3988594 0.78 KMT2A (0.41) HPGDKMT2ANPC1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119859144-B Binuclear macrocyclic metronidazole metal complex and preparation method and application thereof 山东理工大学 2025-06-24 CN disclosed
CN-119859144-A Binuclear macrocyclic metronidazole metal complex and preparation method and application thereof 山东理工大学 2025-04-22 CN disclosed
CN-116082365-B 1,2, 4-Triazolo [3,4-b ] -1,3, 4-thiadiazole myricetin compound and preparation method thereof 贵州大学 2024-11-05 CN disclosed
CN-116082365-A 1,2, 4-triazolo [3,4-b ] -1,3, 4-thiadiazole myricetin compound and preparation method thereof 贵州大学 2023-05-09 CN disclosed
EP-2222326-B2 INHIBITORS OF MALT1 PROTEOLYTIC ACTIVITY AND USES THEREOF VIB VZW (BE) 2015-02-25 EP disclosed
EP-2222326-B1 Inhibitors of MALT1-proteolytic activity and uses thereof VIB VZW (BE) 2012-04-18 EP disclosed
US-20110021548-A1 INHIBITORS OF MALT1 PROTEOLYTIC ACTIVITY AND USES THEREOF UNIVERSITEIT GENT (BE) 2011-01-27 US disclosed
US-20110021548-A1 INHIBITORS OF MALT1 PROTEOLYTIC ACTIVITY AND USES THEREOF UNIVERSITEIT GENT (BE) 2011-01-27 US disclosed
US-20080045514-A1 3-Aryl-6-aryl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2008-02-21 US 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 (2 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-20110021548-A1 INHIBITORS OF MALT1 PROTEOLYTIC ACTIVITY AND USES THEREOF MMEL1, CTRL, ZFR HPGD 3987/4885KMT2A 2852/4885NPC1 2692/4885
US-20080045514-A1 3-Aryl-6-aryl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazines and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP3, CASP1, CASP2 HPGD 2321/4885KMT2A 2333/4885NPC1 3262/4885

“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.