SCHEMBL5433686

SCHEMBL5433686

NCC(O)CNS(=O)(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.55
TRPV4 Q9HBA0 9/20 0.46
ITGA1 P56199 3/20 0.44
RAB9A P51151 1/20 0.44
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
ALOX12 P18054 1/20 0.42
KMT2A Q03164 1/20 0.42
NLRP1 Q9C000 1/20 0.42
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
CCR1 P32246 1/20 0.41
ATM Q13315 1/20 0.41
ITGAV P06756 1/20 0.41

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
SCHEMBL14360908 1.00 GBA1 (0.55) GBA1TRPV4ITGA1RAB9AMEN1
SCHEMBL5447807 0.86 GBA1 (0.59) GBA1TRPV4CCR1ATM
SCHEMBL5447814 0.86 GBA1 (0.59) GBA1TRPV4CCR1ATM
SCHEMBL5440181 0.82 ITGA1 (0.47) TRPV4ITGA1RAB9AMEN1LMNA
SCHEMBL6755655 0.79 ATM (0.58) TRPV4ITGA1RAB9AMEN1LMNA
SCHEMBL14360833 0.76 IDO1 (0.44) TRPV4ITGA1RAB9AMEN1MAPT
SCHEMBL3915576 0.76 RAB9A (0.42) TRPV4ITGA1RAB9AMEN1KMT2A
SCHEMBL3915580 0.76 RAB9A (0.42) TRPV4ITGA1RAB9AMEN1ALOX12
SCHEMBL4777734 0.74 TRPV4 (0.55) TRPV4CCR1
SCHEMBL4128136 0.74 CYP3A4 (0.58) TRPV4MEN1LMNAMAPTKMT2A

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-20070259965-A1 Acyclic 1,3-Diamine And Uses Therefor SMITHKLINE BEECHAM CORPORATION 2007-11-08 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-20070259965-A1 Acyclic 1,3-Diamine And Uses Therefor TRPV4, TRPC4, TRPV1 GBA1 1769/4885TRPV4 1/4885ITGA1 4105/4885

“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.