SCHEMBL9831772

SCHEMBL9831772

Cc1cc(C)n2nc(S(=O)(=O)Nc3c(F)cccc3F)nc2n1.Cc1cc(C)n2nc(S(=O)(=O)Nc3ccccc3C(F)(F)F)nc2n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
USP2 O75604 1/20 0.48
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 3/20 0.43
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
LMNA P02545 2/20 0.42
POLB P06746 2/20 0.42
PKM P14618 1/20 0.41
SLC22A12 Q96S37 1/20 0.41
GAA P10253 1/20 0.40
TP53 P04637 1/20 0.40
MAPK1 P28482 1/20 0.40
NTSR1 P30989 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL9831471 0.93 TSHR (0.55) TSHRUSP2ALDH1A1KMT2AMEN1
SCHEMBL9832297 0.91 TSHR (0.56) TSHRUSP2ALDH1A1LMNAPOLB
SCHEMBL9831351 0.88 TSHR (0.64) TSHRUSP2ALDH1A1LMNAPOLB
SCHEMBL9832602 0.84 TSHR (0.57) TSHRUSP2ALDH1A1KMT2ALMNA
SCHEMBL10658779 0.84 TSHR (0.48) TSHRUSP2ALDH1A1KMT2AMEN1
SCHEMBL10416987 0.83 TSHR (0.47) TSHRUSP2ALDH1A1KMT2AMEN1
SCHEMBL10416985 0.83 TSHR (0.47) TSHRUSP2ALDH1A1KMT2AMEN1
SCHEMBL9832035 0.82 TSHR (0.60) TSHRUSP2ALDH1A1LMNAPOLB
SCHEMBL10665590 0.82 TSHR (0.45) TSHRUSP2ALDH1A1KMT2ACYP1A2
SCHEMBL10662671 0.81 TSHR (0.48) TSHRUSP2ALDH1A1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0142152-B1 Novel substituted 1,2,4-triazolo- [1,5-a] pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1991-03-20 EP claimed