SCHEMBL5163963

SCHEMBL5163963

CCCC(Oc1cccc(C(=N)NO)c1)C(=O)Nc1ccc(N2CCCCC2=O)c(OCC(=O)OCC)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.35
POLB P06746 3/20 0.34
LMNA P02545 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ITGB3 P05106 6/20 0.33
ITGA2B P08514 6/20 0.33
CNR1 P21554 1/20 0.33
PRSS1 P07477 1/20 0.32

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
SCHEMBL5165414 0.92 F10 (0.43) F10ITGB3ITGA2BPRSS1
SCHEMBL5164841 0.90 F10 (0.44) F10POLBLMNAMEN1KMT2A
SCHEMBL5166428 0.88 F10 (0.40) F10POLBLMNAMEN1KMT2A
SCHEMBL5165871 0.83 F10 (0.50) F10LMNAMEN1KMT2ANPC1
SCHEMBL5164723 0.83 F10 (0.50) F10LMNAMEN1KMT2ANPC1
SCHEMBL5164522 0.83 F10 (0.50) F10LMNAMEN1KMT2ANPC1
SCHEMBL5163299 0.82 F10 (0.54) F10ITGB3ITGA2BPRSS1
SCHEMBL5163949 0.81 F10 (0.48) F10POLBMEN1KMT2AITGB3
SCHEMBL5164416 0.81 F10 (0.48) F10POLBMEN1KMT2AITGB3
SCHEMBL5167890 0.80 F10 (0.47) F10POLBMEN1KMT2AITGB3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7273867-B2 Phenyl derivatives MERCK PATENT GMBH (DE) 2007-09-25 US claimed
EP-1351938-B1 PHENYL DERIVATIVES MERCK PATENT GMBH (DE) 2007-04-11 EP claimed
US-20040087582-A1 Phenyl derivatives MERCK PATENT GESELLSCHAFT (DE) 2004-05-06 US claimed
US-7273867-B2 Phenyl derivatives MERCK PATENT GMBH (DE) 2007-09-25 US disclosed
EP-1351938-B1 PHENYL DERIVATIVES MERCK PATENT GMBH (DE) 2007-04-11 EP disclosed
US-20040087582-A1 Phenyl derivatives MERCK PATENT GESELLSCHAFT (DE) 2004-05-06 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-20040087582-A1 Phenyl derivatives F2, F11, SERPINC1 F10 6/4885POLB 4221/4885LMNA 2132/4885

“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.