SCHEMBL5163340

SCHEMBL5163340

N=C(N)c1cccc(OC(C(=O)NCCCN2CCCCC2=O)c2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 8/20 0.58
PRSS1 P07477 5/20 0.58
LMNA P02545 1/20 0.57
POLB P06746 1/20 0.47
F2 P00734 1/20 0.46
NPC1 O15118 1/20 0.45
ATM Q13315 1/20 0.45
USP2 O75604 1/20 0.45
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL5168020 0.97 F10 (0.57) F10PRSS1LMNAPOLBF2
SCHEMBL5372356 0.87 F10 (0.60) F10PRSS1F2TSHR
SCHEMBL5370531 0.81 F10 (0.59) F10PRSS1F2NPC1ALDH1A1
SCHEMBL5165824 0.80 F10 (0.58) F10PRSS1LMNAF2USP2
SCHEMBL14408261 0.79 LMNA (0.47) LMNANPC1ATMALDH1A1KMT2A
SCHEMBL5372968 0.79 TP53 (0.53) F10PRSS1TSHR
SCHEMBL5164409 0.79 F10 (0.73) F10PRSS1F2NPC1ALDH1A1
SCHEMBL5164368 0.78 F10 (0.65) F10PRSS1F2NPC1ALDH1A1
SCHEMBL5164062 0.76 F10 (0.69) F10PRSS1F2NPC1ALDH1A1
SCHEMBL5164065 0.76 F10 (0.68) F10PRSS1F2ALDH1A1

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 9 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
US-7273867-B2 Phenyl derivatives MERCK PATENT GMBH (DE) 2007-09-25 US disclosed
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
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 88/4885LMNA 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.