SCHEMBL4135938

SCHEMBL4135938

CC(C)C[C@@H](C(N)=O)N(CCCCNS(=O)(=O)c1ccc(F)cc1Cl)C(=O)CC1Cc2ccccc2C1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 1/20 0.36
CCR1 P32246 1/20 0.36
KCNA5 P22460 1/20 0.35
ADAM17 P78536 1/20 0.34
NPY5R Q15761 2/20 0.33
TRPV4 Q9HBA0 3/20 0.32
FABP4 P15090 1/20 0.32
HSD11B1 P28845 1/20 0.32
NPY1R P25929 1/20 0.31
NAMPT P43490 1/20 0.31
TBXA2R P21731 1/20 0.31
ACLY P53396 1/20 0.31
TLR4 O00206 1/20 0.31
PIK3CA P42336 2/20 0.30
CAPN1 P07384 2/20 0.30

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
SCHEMBL4141707 0.90 CCR1 (0.39) BMP1CCR1KCNA5ADAM17TRPV4
SCHEMBL4144076 0.89 CCR1 (0.36) BMP1CCR1KCNA5ADAM17TRPV4
SCHEMBL4142970 0.89 CCR1 (0.39) BMP1CCR1KCNA5ADAM17TRPV4
SCHEMBL5429196 0.88 CCR1 (0.40) BMP1CCR1KCNA5ADAM17TRPV4
SCHEMBL4130817 0.84 CCR1 (0.38) BMP1CCR1ADAM17HSD11B1TLR4
SCHEMBL4140995 0.83 CCR1 (0.38) BMP1CCR1ADAM17HSD11B1TLR4
SCHEMBL4141037 0.83 BMP1 (0.37) BMP1CCR1ADAM17TRPV4FABP4
SCHEMBL5439621 0.83 CCR1 (0.38) BMP1CCR1ADAM17TRPV4HSD11B1
SCHEMBL4136298 0.82 CCR1 (0.38) BMP1CCR1KCNA5ADAM17TRPV4
SCHEMBL5435367 0.81 BMP1 (0.40) BMP1CCR1ADAM17TRPV4FABP4

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 claimed

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 BMP1 2172/4885CCR1 766/4885KCNA5 425/4885

“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.