SCHEMBL7997489

SCHEMBL7997489

O=C(O)c1ccc(S(=O)(=O)N(C(=O)[C@@H]2Cc3ccccc3CN2)C(CCCc2ccccc2)CCCc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
TAS2R14 Q9NYV8 13/20 0.40
POLB P06746 1/20 0.38
BMP1 P13497 1/20 0.38
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
CXCR3 P49682 1/20 0.36
PTGES O14684 2/20 0.36
ALOX5 P09917 1/20 0.36
PNMT P11086 1/20 0.35

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
Water SCHEMBL7998607 0.92 MEN1 (0.50) MEN1KMT2ACXCR3PNMT
SCHEMBL7854932 0.84 PDE4A (0.46) MEN1KMT2ATAS2R14POLB
SCHEMBL7997692 0.83 MEN1 (0.50) MEN1KMT2ACXCR3PNMT
SCHEMBL15639710 0.74 MEN1 (0.51) MEN1KMT2APOLB
SCHEMBL7855499 0.69 KMT2A (0.67) MEN1KMT2APOLBCXCR3
SCHEMBL7772874 0.68 PDE4A (0.47) POLB
SCHEMBL17031946 0.67 MEN1 (0.49) MEN1KMT2A
SCHEMBL6431289 0.65 MEN1 (0.61) MEN1KMT2ACXCR3
SCHEMBL17024683 0.65 MEN1 (0.49) MEN1KMT2A
SCHEMBL17024684 0.65 MEN1 (0.49) MEN1KMT2A

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
WO-2001010838-A1 MULTIVALENT COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2001-02-15 WO disclosed