SCHEMBL5164779

SCHEMBL5164779

CCCC(Oc1cccc(C(=N)N)c1)C(=O)Nc1ccc(N2CCCC2=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.58
PRSS1 P07477 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 3/20 0.48
ALDH1A1 P00352 2/20 0.48
RAB9A P51151 2/20 0.48
TP53 P04637 1/20 0.48
GLA P06280 1/20 0.48
PKM P14618 1/20 0.48
KDM1A O60341 1/20 0.46
MAOB P27338 1/20 0.46
MAPT P10636 1/20 0.46
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL5166567 0.97 F10 (0.61) F10PRSS1SMN1; SMN2NPC1ALDH1A1
SCHEMBL5166247 0.97 F10 (0.61) F10PRSS1SMN1; SMN2NPC1ALDH1A1
SCHEMBL5166188 0.97 F10 (0.61) F10PRSS1SMN1; SMN2NPC1ALDH1A1
SCHEMBL5166914 0.94 F10 (0.59) F10PRSS1SMN1; SMN2NPC1ALDH1A1
SCHEMBL5166225 0.92 F10 (0.60) F10PRSS1SMN1; SMN2NPC1ALDH1A1
SCHEMBL5164357 0.91 F10 (0.62) F10PRSS1SMN1; SMN2NPC1ALDH1A1
SCHEMBL5163878 0.91 F10 (0.53) F10PRSS1SMN1; SMN2NPC1ALDH1A1
SCHEMBL5165424 0.89 F10 (0.47) F10PRSS1SMN1; SMN2NPC1ALDH1A1
SCHEMBL5166255 0.89 F10 (0.46) F10PRSS1ALDH1A1HSD17B10
SCHEMBL14408282 0.88 F10 (0.51) F10PRSS1SMN1; SMN2NPC1ALDH1A1

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 6/4885PRSS1 88/4885SMN1; 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.