SCHEMBL4131370

SCHEMBL4131370

COCCCN(CCCCNS(=O)(=O)c1ccc(F)cc1C(F)(F)F)C(=O)NC(C)C

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.49
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
USP2 O75604 1/20 0.40
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
CNR1 P21554 4/20 0.38
GSTO1 P78417 1/20 0.36
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
HSD11B1 P28845 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
SCHEMBL4131367 0.88 CNR2 (0.41) CNR2POLBL3MBTL1SMN1; SMN2USP2
SCHEMBL4148569 0.87 GSTO1 (0.43) CNR2POLBL3MBTL1SMN1; SMN2USP2
SCHEMBL4136637 0.82 CNR2 (0.39) CNR2SMN1; SMN2USP2CNR1ALDH1A1
SCHEMBL4136648 0.82 CNR2 (0.39) CNR2SMN1; SMN2USP2CNR1ALDH1A1
SCHEMBL4134999 0.80 GSTO1 (0.44) POLBL3MBTL1GSTO1ALDH1A1HPGD
SCHEMBL4140628 0.78 TP53 (0.35) CNR2CNR1ALDH1A1LMNA
SCHEMBL4140623 0.78 TP53 (0.35) CNR2CNR1ALDH1A1LMNA
SCHEMBL4148564 0.76 CCR1 (0.40) POLBSMN1; SMN2USP2GSTO1ALDH1A1
SCHEMBL4145496 0.75 NPY5R (0.48) L3MBTL1ALDH1A1
SCHEMBL4136888 0.73 CNR2 (0.39) CNR2SMN1; SMN2USP2CNR1ALDH1A1

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 CNR2 57/4885POLB 4857/4885L3MBTL1 3940/4885

“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.