SCHEMBL6602234

SCHEMBL6602234

Cc1nnsc1C(=O)Nc1ccccc1C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.69
LMNA P02545 2/20 0.68
HTT P42858 1/20 0.62
GAA P10253 3/20 0.60
TDP1 Q9NUW8 1/20 0.57
CA12 O43570 2/20 0.57
CA2 P00918 2/20 0.57
CA9 Q16790 2/20 0.57
ALDH1A1 P00352 3/20 0.55
POLB P06746 2/20 0.55
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ABCC8 Q09428 1/20 0.50
KCNJ11 Q14654 1/20 0.50
PKM P14618 1/20 0.49
DHODH Q02127 1/20 0.48

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
SCHEMBL23367923 0.84 USP2 (0.74) USP2LMNAHTTGAATDP1
SCHEMBL7043652 0.81 LMNA (1.00) USP2LMNAHTTGAATDP1
SCHEMBL21652255 0.80 USP2 (0.67) USP2LMNAHTTGAATDP1
SCHEMBL2859024 0.79 ABCC8 (0.53) USP2LMNAHTTCA12CA2
SCHEMBL11290448 0.78 CA12 (0.57) GAACA12CA2CA9ALDH1A1
SCHEMBL7972108 0.76 LMNA (0.84) USP2LMNAHTTGAATDP1
SCHEMBL8252530 0.72 ALDH1A1 (0.72) LMNAHTTTDP1CA12CA2
SCHEMBL6621449 0.72 LMNA (0.77) USP2LMNAHTTGAATDP1
SCHEMBL11538782 0.71 LMNA (0.62) USP2LMNAGAATDP1ALDH1A1
SCHEMBL2058331 0.71 ALDH1A1 (0.68) CA12CA2CA9ALDH1A1POLB

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-1433787-A1 1,2,3-Thiadiazole derivatives, plant disease controller and method for using them Nihon Nohyaku Co., Ltd. (JP) 2004-06-30 EP disclosed
EP-0987257-B1 1,2,3-THIADIAZOLE DERIVATIVES, PLANT DISEASE CONTROLLING AGENT, AND METHOD FOR USE THEREOF NIHON NOHYAKU CO LTD (JP) 2004-04-14 EP disclosed
US-6348460-B1 TREATMENT OF PLANT DISEASES NIHON NOHYAKU CO., LTD. (JP) 2002-02-19 US disclosed
EP-0987257-A1 1,2,3-THIADIAZOLE DERIVATIVES, PLANT DISEASE CONTROLLING AGENT, AND METHOD FOR USE THEREOF Nihon Nohyaku Co., Ltd. (JP) 2000-03-22 EP disclosed