SCHEMBL5164572

SCHEMBL5164572

Cc1cc(NC(=O)[C@@H](Nc2cccc(C(=N)N)c2)c2ccccc2)ccc1N1CCCCC1=O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 8/20 0.77
MAPT P10636 3/20 0.45
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.45
PRSS1 P07477 5/20 0.44
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 2/20 0.42
THRB P10828 1/20 0.42
HPN P05981 2/20 0.40
PLAU P00749 1/20 0.40
NPC1 O15118 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
PLG P00747 1/20 0.39
PROC P04070 1/20 0.39

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
SCHEMBL5164881 0.93 F10 (0.66) F10MAPTALDH1A1KDM4EPOLB
SCHEMBL5165612 0.90 F10 (0.77) F10MAPTALDH1A1KDM4EPOLB
SCHEMBL5165637 0.89 F10 (0.61) F10MAPTALDH1A1KDM4EPOLB
SCHEMBL5164794 0.88 F10 (0.60) F10MAPTALDH1A1KDM4EPOLB
SCHEMBL6808410 0.88 F10 (0.95) F10MAPTALDH1A1KDM4EPOLB
SCHEMBL5165960 0.87 F10 (1.00) F10MAPTALDH1A1KDM4EPOLB
SCHEMBL5166204 0.87 F10 (1.00) F10MAPTALDH1A1KDM4EPOLB
SCHEMBL5371292 0.86 F10 (0.98) F10MAPTALDH1A1KDM4EPOLB
SCHEMBL5166356 0.86 F10 (0.62) F10PRSS1PLAUF2
SCHEMBL5165361 0.86 F10 (0.56) F10F7

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 6/4885MAPT 4360/4885ALDH1A1 489/4885

“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.