SCHEMBL22188698

SCHEMBL22188698

CCOc1cc(F)n2nc(S(=O)(=O)Nc3c(Cl)cccc3C(=O)O)nc2n1.CCOc1nc(F)cc2nc(S(=O)(=O)Nc3c(Cl)cccc3C(=O)O)nn12

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.34
CCR2 P41597 2/20 0.32
ACLY P53396 2/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
CCR4 P51679 1/20 0.30
CCR5 P51681 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL4890265 0.91 WDR5 (0.39) WDR5CCR2ACLYALDH1A1SMN1; SMN2
SCHEMBL29396759 0.91 WDR5 (0.39) WDR5CCR2ACLYALDH1A1SMN1; SMN2
SCHEMBL118467 0.91 WDR5 (0.39) WDR5CCR2ACLYALDH1A1SMN1; SMN2
SCHEMBL29500281 0.91 WDR5 (0.37) WDR5CCR2ACLYALDH1A1CCR4
SCHEMBL30416435 0.84 CA2 (0.34) WDR5ALDH1A1TSHR
SCHEMBL64266 0.84 CA2 (0.34) WDR5ALDH1A1TSHR
SCHEMBL18643336 0.83 CA2 (0.40) ALDH1A1TSHR
Diclosulam SCHEMBL2231960 0.83 CA2 (0.33) WDR5ALDH1A1TSHR
SCHEMBL8848603 0.83 WDR5 (0.42) WDR5ALDH1A1
Diclosulam SCHEMBL116344 0.83 GNRHR (0.35) ALDH1A1SMN1; SMN2CCR4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11884821-B2 Composition, polymer composite article formed therewith, and method of preparing same DOW SILICONES CORPORATION (US) 2024-01-30 US disclosed
US-10836908-B2 Composition, polymer composite article formed therewith, and method of preparing same DOW SILICONES CORPORATION (US) 2020-11-17 US disclosed
US-20200216668-A1 COMPOSITION, POLYMER COMPOSITE ARTICLE FORMED THEREWITH, AND METHOD OF PREPARING SAME DOW GLOBAL TECHNOLOGIES LLC 2020-07-09 US disclosed