SCHEMBL4758230

SCHEMBL4758230

Cc1c(Cl)ccc(S(=O)(=O)Cl)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 0.38
WDR5 P61964 1/20 0.35
CES1 P23141 1/20 0.34
GAA P10253 3/20 0.34
ALOX15 P16050 3/20 0.34
HSD17B10 Q99714 3/20 0.34
ALDH1A1 P00352 3/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 2/20 0.33
HSD11B1 P28845 2/20 0.33
LMNA P02545 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
DPP4 P27487 1/20 0.32
HTT P42858 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PKM P14618 1/20 0.31

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
SCHEMBL4187153 0.82 TRPV4 (0.35) TRPV4GAAALOX15HSD17B10ALDH1A1
SCHEMBL184577 0.79 TRPV4 (0.40) TRPV4CES1HSD17B10ALDH1A1HPGD
SCHEMBL3550070 0.79 LMNA (0.43) TRPV4WDR5CES1ALDH1A1HPGD
SCHEMBL32690962 0.76 TRPV4 (0.42) TRPV4WDR5CES1TSHRHSD11B1
SCHEMBL8764082 0.75 TSHR (0.40) TRPV4WDR5CES1GAAALOX15
SCHEMBL8173346 0.73 TRPV4 (0.47) TRPV4HSD17B10ALDH1A1KMT2AMEN1
SCHEMBL11699414 0.73 DPP4 (0.42) CES1GAAALOX15HSD17B10ALDH1A1
SCHEMBL28639974 0.72 TRPV4 (0.38) TRPV4WDR5CES1KMT2AMEN1
SCHEMBL27142166 0.72 TRPV4 (0.42) TRPV4WDR5CES1TSHRLMNA
SCHEMBL5516395 0.72 TRPV4 (0.42) TRPV4HSD11B1LMNAHTTSMN1; SMN2

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
WO-2008011557-A2 HETEROARYL INHIBITORS OF RHO KINASE BORCHARDT ALLEN J (US) 2008-01-24 WO disclosed
US-20080021217-A1 HETEROCYCLIC INHIBITORS OF RHO KINASE Borchardt, Allen (US) 2008-01-24 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-20080021217-A1 HETEROCYCLIC INHIBITORS OF RHO KINASE ROCK1, ROCK2, RHOA TRPV4 3880/4885WDR5 1982/4885CES1 2354/4885

“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.