SCHEMBL799304

SCHEMBL799304

CC(C)c1cc(Cl)cc(S(=O)(=O)N(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.39
VCAM1 P19320 1/20 0.38
ALDH1A1 P00352 5/20 0.38
MAPT P10636 3/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CNR1 P21554 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
GBA1 P04062 1/20 0.35
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35
HSD17B10 Q99714 1/20 0.35
FABP3 P05413 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
SCHEMBL11685020 0.82 ALDH1A1 (0.50) VCAM1ALDH1A1MAPTLMNAHTT
SCHEMBL25556532 0.79 PGR (0.41) PGRFABP3FABP4FABP5
SCHEMBL171613 0.76 VCAM1 (0.41) VCAM1ALDH1A1MAPTLMNAHTT
SCHEMBL4734618 0.75 LMNA (0.55) VCAM1ALDH1A1MAPTLMNAHTT
SCHEMBL25011454 0.73 SMN1; SMN2 (0.39) ALDH1A1MAPTLMNAHTTMEN1
SCHEMBL10176298 0.73 RAB9A (0.51) ALDH1A1MAPTHTTNPSR1MEN1
SCHEMBL19756404 0.71 PIK3C3 (0.40) ALDH1A1MAPTLMNAHTTNPSR1
SCHEMBL196630 0.71 SMN1; SMN2 (0.50) PGRVCAM1ALDH1A1MAPTLMNA
SCHEMBL11574451 0.71 GABRA1 (0.46) PGRALDH1A1LMNAHTTCNR1
SCHEMBL422198 0.71 TSHR (0.50) PGRALDH1A1LMNAHTTCNR1

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
US-20120071475-A1 UREA DERIVATIVES HAVING PI3K-INHIBITING ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-03-22 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-20120071475-A1 UREA DERIVATIVES HAVING PI3K-INHIBITING ACTIVITY MTOR, STAT3, SLC14A1 PGR 2739/4885VCAM1 1137/4885ALDH1A1 3750/4885

“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.