SCHEMBL4136648

SCHEMBL4136648

COCC(CN(CCCCNS(=O)(=O)c1ccc(F)cc1C(F)(F)F)C(=O)NC(C)C)OC(=O)Nc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.39
PKM P14618 1/20 0.33
PTGES O14684 1/20 0.32
FABP4 P15090 2/20 0.32
CNR1 P21554 3/20 0.32
RBP4 P02753 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 2/20 0.31
USP2 O75604 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
IDH2 P48735 1/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 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
SCHEMBL4136637 1.00 CNR2 (0.39) CNR2PKMPTGESFABP4CNR1
SCHEMBL4136888 0.92 CNR2 (0.39) CNR2PKMFABP4CNR1RBP4
SCHEMBL4135477 0.92 CNR2 (0.39) CNR2PKMFABP4CNR1RBP4
SCHEMBL4148627 0.90 BMP1 (0.37) PKMPTGESFABP4MEN1MAPT
SCHEMBL4148621 0.90 BMP1 (0.37) PKMPTGESFABP4MEN1MAPT
SCHEMBL4135071 0.84 TRPV4 (0.39) PKMPTGESFABP4MEN1KMT2A
SCHEMBL4129723 0.84 TRPV4 (0.39) PKMPTGESFABP4MEN1KMT2A
SCHEMBL4129734 0.84 TRPV4 (0.39) PKMPTGESFABP4MEN1KMT2A
SCHEMBL4130838 0.83 TRPV4 (0.37) CNR2PKMCNR1
SCHEMBL4140623 0.83 TP53 (0.35) CNR2PTGESFABP4CNR1ALDH1A1

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
US-20090105259-A1 Acyclic 1,4-Diamines and Uses Thereof SMITHKLINE BEECHAM CORPORATION 2009-04-23 US claimed
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 57/4885PKM 2536/4885PTGES 1099/4885

“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.