SCHEMBL2863835

SCHEMBL2863835

CC(C)c1cccc(NC(=O)c2snnc2C2CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CBLB Q13191 14/20 0.48
FADS1 O60427 1/20 0.46
USP36 Q9P275 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
ABCC8 Q09428 1/20 0.45
KCNJ11 Q14654 1/20 0.45
LMNA P02545 1/20 0.44
BRAF P15056 1/20 0.43

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
SCHEMBL2864396 0.85 USP36 (0.52) CBLBUSP36ABCC8KCNJ11LMNA
SCHEMBL2868108 0.78 KDM4E (0.55) ABCC8KCNJ11LMNA
SCHEMBL12852342 0.73 ABCC8 (0.50) CBLBABCC8KCNJ11LMNA
SCHEMBL20306602 0.70 LMNA (0.44) CBLBFADS1USP36ABCC8KCNJ11
SCHEMBL23367925 0.70 RAB9A (0.72) FADS1LMNA
SCHEMBL9978845 0.70 FADS1 (0.64) CBLBFADS1RXFP1BRAF
SCHEMBL14441194 0.69 LMNA (0.70) FADS1RXFP1LMNABRAF
SCHEMBL2859024 0.69 ABCC8 (0.53) RXFP1ABCC8KCNJ11LMNA
SCHEMBL2866454 0.69 SMN1; SMN2 (0.57) LMNA
SCHEMBL23844177 0.69 FADS1 (0.62) CBLBFADS1RXFP1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 claimed
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 CBLB 2751/4885FADS1 1025/4885USP36 2168/4885

“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.