SCHEMBL5163880

SCHEMBL5163880

Cc1cc(NC(=O)C(Cc2cccc(C(=N)NO)c2)c2ccccc2)ccc1N1CCCCC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.46
PARP1 P09874 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HDAC3 O15379 4/20 0.38
HDAC4 P56524 4/20 0.38
HDAC1 Q13547 4/20 0.38
HDAC8 Q9BY41 4/20 0.38
HDAC6 Q9UBN7 4/20 0.38
KCNQ2 O43526 3/20 0.38
ALDH1A1 P00352 2/20 0.38
ITGB3 P05106 4/20 0.37
ITGA2B P08514 4/20 0.37
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HDAC7 Q8WUI4 3/20 0.36
HDAC2 Q92769 3/20 0.36
HDAC10 Q969S8 3/20 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
SCHEMBL5166719 0.92 F10 (0.55) F10PARP1SMN1; SMN2ITGB3ITGA2B
SCHEMBL5164516 0.89 F10 (0.58) F10SMN1; SMN2HDAC3HDAC4HDAC1
SCHEMBL5165774 0.87 F10 (0.42) F10PARP1SMN1; SMN2HDAC3HDAC1
Hydrochloric Acid SCHEMBL27601429 0.86 F10 (0.42) F10PARP1SMN1; SMN2HDAC3HDAC1
SCHEMBL5166391 0.84 F10 (0.40) F10PARP1SMN1; SMN2HDAC3HDAC4
Hydrochloric Acid SCHEMBL27583902 0.84 F10 (0.39) F10PARP1SMN1; SMN2HDAC3HDAC4
SCHEMBL5164661 0.82 F10 (0.43) F10PARP1SMN1; SMN2ALDH1A1MAPT
SCHEMBL5163366 0.79 F10 (0.71) F10SMN1; SMN2KCNQ2ALDH1A1MAPT
SCHEMBL5164836 0.79 F10 (0.46) F10PARP1KMT2ATSHR
SCHEMBL5166428 0.78 F10 (0.40) F10ALDH1A1POLBMEN1KMT2A

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 6/4885PARP1 477/4885SMN1; SMN2 3430/4885

“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.