SCHEMBL2867253

SCHEMBL2867253

CC(C)c1nnsc1C(=O)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC8 Q09428 1/20 0.50
KCNJ11 Q14654 1/20 0.50
TSHR P16473 3/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 4/20 0.47
KMT2A Q03164 2/20 0.47
SLC6A2 P23975 2/20 0.47
SLC6A3 Q01959 2/20 0.47
ATM Q13315 2/20 0.45
ALDH1A1 P00352 5/20 0.45
LMNA P02545 2/20 0.44
ELANE P08246 3/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41

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
SCHEMBL18924216 0.83 TSHR (0.56) ABCC8KCNJ11TSHRRAB9ASMN1; SMN2
SCHEMBL2862045 0.76 ABCC8 (0.50) ABCC8KCNJ11TSHRRAB9ASMN1; SMN2
SCHEMBL22005508 0.74 ILK (0.51) TSHRRAB9ASMN1; SMN2TDP1KMT2A
SCHEMBL19923805 0.72 TDP1 (0.47) TSHRRAB9ASMN1; SMN2TDP1KMT2A
SCHEMBL18869086 0.71 TDP1 (0.50) TSHRRAB9ASMN1; SMN2TDP1KMT2A
SCHEMBL22005553 0.71 RAB9A (0.53) TSHRRAB9ASMN1; SMN2TDP1KMT2A
SCHEMBL20154221 0.71 RAB9A (0.56) TSHRRAB9ASMN1; SMN2TDP1KMT2A
SCHEMBL5717545 0.71 ABCC8 (0.41) ABCC8KCNJ11TSHRRAB9ATDP1
SCHEMBL20154271 0.71 RAB9A (0.59) TSHRRAB9ASMN1; SMN2TDP1KMT2A
SCHEMBL20154222 0.70 RAB9A (0.55) TSHRRAB9ASMN1; SMN2TDP1KMT2A

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 1207/4885TSHR 653/4885

“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.