SCHEMBL2852234

SCHEMBL2852234

CC(C)Oc1ccc(NC(=O)C2CCCC(S(=O)(=O)c3ccccc3)C2)nc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.48
ENPP3 O14638 3/20 0.44
ENPP1 P22413 3/20 0.44
ENPP2 Q13822 2/20 0.44
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
DEGS1 O15121 1/20 0.41
GCK P35557 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
PIK3CG P48736 1/20 0.40
ELOVL6 Q9H5J4 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
SCHEMBL2852237 1.00 ABL1 (0.48) ABL1ENPP3ENPP1ENPP2KMT2A
SCHEMBL2849781 0.92 ABL1 (0.48) ABL1KMT2AMEN1DEGS1GCK
SCHEMBL2849782 0.92 ABL1 (0.48) ABL1KMT2AMEN1DEGS1GCK
SCHEMBL710662 0.90 ABL1 (0.52) ABL1KMT2AMEN1DEGS1NPC1
SCHEMBL2851400 0.90 ABL1 (0.52) ABL1KMT2AMEN1DEGS1NPC1
SCHEMBL2851423 0.88 ABL1 (0.46) ABL1KMT2AMEN1DEGS1NPC1
SCHEMBL711474 0.88 ABL1 (0.46) ABL1KMT2AMEN1DEGS1NPC1
SCHEMBL13135944 0.85 ENPP3 (0.54) ENPP3ENPP1ENPP2KMT2AMEN1
SCHEMBL2853568 0.85 ENPP3 (0.54) ENPP3ENPP1ENPP2KMT2AMEN1
SCHEMBL2846099 0.85 ENPP3 (0.54) ENPP3ENPP1ENPP2KMT2AMEN1

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-2236494-B1 SULFONYL SUBSTITUTED 6-MEMBERED RING DERIVATIVE MSD KK (JP) 2016-08-31 EP claimed
EP-2236494-A1 SULFONYL SUBSTITUTED 6-MEMBERED RING DERIVATIVE Banyu Pharmaceutical Co., Ltd. (JP) 2010-10-06 EP claimed
EP-2236494-B1 SULFONYL SUBSTITUTED 6-MEMBERED RING DERIVATIVE MSD KK (JP) 2016-08-31 EP disclosed
EP-2236494-A1 SULFONYL SUBSTITUTED 6-MEMBERED RING DERIVATIVE Banyu Pharmaceutical Co., Ltd. (JP) 2010-10-06 EP disclosed
US-20100249147-A1 SULFONYL-SUBSTITUTED 6-MEMBERED RING DERIVATIVE MSD K.K. (JP) 2010-09-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100249147-A1 SULFONYL-SUBSTITUTED 6-MEMBERED RING DERIVATIVE CHRM2, CHRM3, CHRM1 ABL1 3478/4885ENPP3 3366/4885ENPP1 4235/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.