SCHEMBL9066675

SCHEMBL9066675

COc1nc(Cl)cc2nc(S(=O)(=O)Nc3c(F)cccc3C(=O)O)nn12

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.38
TSHR P16473 1/20 0.35
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CCR4 P51679 1/20 0.34

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
SCHEMBL8901664 0.92 SMN1; SMN2 (0.39) TSHRGAAMAPK1KMT2ASMN1; SMN2
SCHEMBL8901668 0.84 MAPT (0.35) TSHRMAPK1KMT2ASMN1; SMN2
SCHEMBL8902858 0.83 SMN1; SMN2 (0.35) TSHRGAAMAPK1KMT2ASMN1; SMN2
SCHEMBL8848603 0.81 WDR5 (0.42) GAAKMT2A
SCHEMBL910274 0.80 GAA (0.42) ACLYTSHRGAAMAPK1KMT2A
SCHEMBL9065805 0.80 FABP4 (0.36) TSHRGAAMAPK1KMT2ASMN1; SMN2
SCHEMBL7074184 0.78 TSHR (0.34) TSHRGAAMAPK1KMT2ASMN1; SMN2
SCHEMBL8113251 0.77 LMNA (0.37) TSHRGAAKMT2ASMN1; SMN2
SCHEMBL4890265 0.76 WDR5 (0.39) ACLYSMN1; SMN2CCR4
SCHEMBL118467 0.76 WDR5 (0.39) ACLYSMN1; SMN2CCR4

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
EP-0512739-B1 Herbicidal compositions with reduced phytotoxicity DOWELANCO (US) 1996-11-06 EP disclosed
EP-0515679-A4 PRECIPITATED FLOWABLE CONCENTRATE FORMULATIONS, THEIR PREPARATION AND THEIR AGRICULTURAL USES 1993-06-09 EP disclosed
EP-0515679-A1 PRECIPITATED FLOWABLE CONCENTRATE FORMULATIONS, THEIR PREPARATION AND THEIR AGRICULTURAL USES DOWELANCO (US) 1992-12-02 EP disclosed
EP-0512739-A1 Herbicidal compositions with reduced phytotoxicity DOWELANCO (US) 1992-11-11 EP disclosed
WO-1992010937-A1 PRECIPITATED FLOWABLE CONCENTRATE FORMULATIONS, THEIR PREPARATION AND THEIR AGRICULTURAL USES DOWELANCO (US) 1992-07-09 WO disclosed