SCHEMBL2862957

SCHEMBL2862957

N#Cc1ccccc1NC(=O)c1snnc1C1CC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCC8 Q09428 1/20 0.49
KCNJ11 Q14654 1/20 0.49
KMT2A Q03164 3/20 0.43
USP2 O75604 1/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
EPHB3 P54753 1/20 0.42
KDM4E B2RXH2 2/20 0.42
GAA P10253 2/20 0.42
CYP1A2 P05177 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PDE5A O76074 1/20 0.41
PDE1A P54750 1/20 0.41
PDE1B Q01064 1/20 0.41
PDE1C Q14123 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
IRAK4 Q9NWZ3 2/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 2/20 0.39

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
SCHEMBL2859024 0.81 ABCC8 (0.53) ABCC8KCNJ11KMT2AUSP2NPC1
SCHEMBL20302009 0.77 L3MBTL1 (0.44) KMT2AUSP2NPC1RAB9AEPHB3
SCHEMBL12855223 0.75 ATM (0.49) ABCC8KCNJ11KMT2AUSP2NPC1
SCHEMBL12852342 0.73 ABCC8 (0.50) ABCC8KCNJ11KMT2AKDM4E
SCHEMBL2866454 0.71 SMN1; SMN2 (0.57) KMT2ANPC1RAB9AKDM4ECYP1A2
SCHEMBL24093709 0.70 KDM4E (0.49) KMT2AUSP2NPC1RAB9AEPHB3
SCHEMBL29395460 0.70 ALDH1A1 (0.48) KMT2ANPC1RAB9AEPHB3KDM4E
SCHEMBL22380 0.70 ALDH1A1 (0.48) KMT2ANPC1RAB9AEPHB3KDM4E
SCHEMBL2872524 0.70 ABCC8 (0.58) ABCC8KCNJ11KMT2AUSP2NPC1
SCHEMBL2868146 0.69 ABCC8 (0.47) ABCC8KCNJ11KDM4EGAASMN1; SMN2

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
EP-1852428-B1 4-CYCLOPROPYL-1,2,3-THIADIAZOLE COMPOUND, AGROHORTICULTURAL PLANT DISEASE CONTROLLING AGENT AND METHOD OF USING THE SAME NIHON NOHYAKU CO LTD (JP) 2012-05-16 EP disclosed
US-7786040-B2 4-cyclopropyl-1,2,3,-thiadiazole compound, agrohorticultural plant disease controlling agent and method of using the same NIHON NOHYAKU CO., LTD. (JP) 2010-08-31 US disclosed
US-20080200457-A1 4-Cyclopropyl-1,2,3,-Thiadiazole Compound, Agrohorticultural Plant Disease Controlling Agent And Method Of Using The Same NIHON NOHYAKU CO., LTD. (JP) 2008-08-21 US disclosed
EP-1852428-A1 4-CYCLOPROPYL-1,2,3-THIADIAZOLE COMPOUND, AGROHORTICULTURAL PLANT DISEASE CONTROLLING AGENT AND METHOD OF USING THE SAME Nihon Nohyaku Co., Ltd. (JP) 2007-11-07 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-20080200457-A1 4-Cyclopropyl-1,2,3,-Thiadiazole Compound, Agrohorticultural Plant Disease Controlling Agent And Method Of Using The Same CBR3, CBR1, OSR1 ABCC8 1005/4885KCNJ11 1207/4885KMT2A 2053/4885

“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.