SCHEMBL3664636

SCHEMBL3664636

CCCCCCCCCC(CCCCCC)S(=O)(=O)Cl

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.43
CA2 P00918 9/20 0.40
CA1 P00915 8/20 0.40
CA9 Q16790 7/20 0.40
GPR84 Q9NQS5 3/20 0.40
CA12 O43570 3/20 0.40
CA7 P43166 3/20 0.40
CA14 Q9ULX7 3/20 0.40
FDPS P14324 3/20 0.40
CA3 P07451 2/20 0.40
CA4 P22748 2/20 0.40
CA6 P23280 2/20 0.40
CA5A P35218 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
FFAR1 O14842 1/20 0.40
FAAH O00519 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL14641579 0.98 DNM1 (0.42) TP53CA2CA1CA9GPR84
SCHEMBL3627346 0.96 TP53 (0.41) TP53CA2CA1CA9GPR84
SCHEMBL14892962 0.95 TP53 (0.43) TP53CA2CA1CA9GPR84
SCHEMBL14627179 0.91 TP53 (0.41) TP53CA2CA1CA9GPR84
SCHEMBL27289489 0.90 TP53 (0.37) TP53CA2CA1CA9FDPS
SCHEMBL10745083 0.88 TP53 (0.42) TP53CA2CA1CA9GPR84
SCHEMBL17213651 0.86 CA2 (0.34) TP53CA2CA1CA9CA12
SCHEMBL20084326 0.81 TSHR (0.38) TP53CA2CA1FDPS
SCHEMBL7864585 0.81 TP53 (0.43) TP53CA2GPR84FDPSFFAR1
SCHEMBL10770770 0.80 TP53 (0.46) TP53CA2CA1CA9GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2235543-A1 METHOD TO DETERMINE LIPIDS Axis-Shield Asa (NO) 2010-10-06 EP disclosed
WO-2009081140-A1 METHOD TO DETERMINE LIPIDS AXIS-SHIELD ASA (NO) 2009-07-02 WO disclosed