SCHEMBL4132204

SCHEMBL4132204

CC(C)C[C@H](CNCCCCNS(=O)(=O)c1ccc(Cl)cc1Cl)NC(=O)Nc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
TRPV4 Q9HBA0 5/20 0.41
ITGA1 P56199 3/20 0.40
FABP4 P15090 1/20 0.39
IDH1 O75874 3/20 0.38
CCR1 P32246 1/20 0.38
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
CNR1 P21554 1/20 0.37
ATM Q13315 1/20 0.37
PSMB5 P28074 1/20 0.37

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
SCHEMBL4132203 1.00 MAPK1 (0.45) MAPK1TRPV4ITGA1FABP4IDH1
SCHEMBL14605688 0.90 TRPV4 (0.41) MAPK1TRPV4ITGA1FABP4CCR1
SCHEMBL14605764 0.90 TRPV4 (0.43) MAPK1TRPV4ITGA1FABP4IDH1
SCHEMBL14605691 0.89 TRPV4 (0.44) TRPV4ITGA1FABP4IDH1CCR1
SCHEMBL14606012 0.89 ITGAV (0.41) MAPK1TRPV4IDH1CCR1CNR1
SCHEMBL4135486 0.88 CCR1 (0.42) TRPV4FABP4CCR1MEN1KMT2A
SCHEMBL4142782 0.87 MAPK1 (0.43) MAPK1TRPV4ITGA1CCR1MEN1
SCHEMBL14605592 0.87 ALDH1A1 (0.40) TRPV4MEN1NPC1LMNAMAPT
SCHEMBL13872425 0.86 MAPK1 (0.43) MAPK1TRPV4ITGA1FABP4IDH1
SCHEMBL14606011 0.86 CCR1 (0.39) TRPV4CCR1CNR1ATM

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-20090105259-A1 Acyclic 1,4-Diamines and Uses Thereof SMITHKLINE BEECHAM CORPORATION 2009-04-23 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-20090105259-A1 Acyclic 1,4-Diamines and Uses Thereof TRPV4, TRPC4, TRPV1 MAPK1 1486/4885TRPV4 1/4885ITGA1 3929/4885

“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.