SCHEMBL2009648

SCHEMBL2009648

CCN(CC)C(=O)COc1ccc(C(=O)CN2Cc3cc(C#N)ccc3C2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.43
PRMT5 O14744 2/20 0.42
WDR77 Q9BQA1 2/20 0.42
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
GAA P10253 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
MAPT P10636 2/20 0.37
CYP19A1 P11511 1/20 0.36

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
SCHEMBL2012689 0.88 ALK (0.45) ITGB3ITGA2BGAAALDH1A1GABRA1
SCHEMBL2008928 0.86 AOC3 (0.42) PRMT5WDR77ITGB3ITGA2BRAB9A
SCHEMBL2009859 0.85 ITGB3 (0.52) PRMT5WDR77ITGB3ITGA2BRAB9A
SCHEMBL2011569 0.85 ITGB3 (0.44) PRMT5WDR77ITGB3ITGA2BRAB9A
SCHEMBL2013975 0.84 ITGB3 (0.42) PRMT5WDR77ITGB3ITGA2BRAB9A
SCHEMBL2014017 0.83 ITGB3 (0.40) PRMT5WDR77ITGB3ITGA2BRAB9A
SCHEMBL2008790 0.82 ITGB3 (0.39) PRMT5WDR77ITGB3ITGA2BRAB9A
SCHEMBL2011666 0.79 ITGB3 (0.46) PRMT5WDR77ITGB3ITGA2BRAB9A
SCHEMBL2011031 0.78 GABRA1 (0.40) PRMT5WDR77ITGB3ITGA2BALDH1A1
SCHEMBL2011573 0.78 ALK (0.44) GAAKDM4EALDH1A1GLAGABRA1

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-7964628-B2 Fibrinogen receptor antagonists and their use PIRAMAL LIFE SCIENCES LIMITED (IN) 2011-06-21 US disclosed
US-20100256161-A1 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE PIRAMAL LIFE SCIENCES LIMITED (IN) 2010-10-07 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-20100256161-A1 FIBRINOGEN RECEPTOR ANTAGONISTS AND THEIR USE FGB, F13B, F2 TRPM8 2420/4885PRMT5 1856/4885WDR77 3911/4885

“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.