SCHEMBL5164872

SCHEMBL5164872

NCc1ccc(OC(C(=O)Nc2ccc(N3CCCCC3=O)cc2)c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 8/20 0.55
PRSS1 P07477 1/20 0.47
MAPT P10636 3/20 0.44
KMT2A Q03164 2/20 0.43
USP2 O75604 1/20 0.43
ESR1 P03372 1/20 0.43
NR4A1 P22736 1/20 0.43
PTK2B Q14289 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
TSHR P16473 3/20 0.43
NAMPT P43490 1/20 0.42
NPC1 O15118 3/20 0.42
ALDH1A1 P00352 3/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 1/20 0.42
GLA P06280 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
SCHEMBL5163826 0.94 F10 (0.55) F10PRSS1MAPTKMT2AUSP2
SCHEMBL5165310 0.89 F10 (0.57) F10PRSS1MAPTKMT2AUSP2
SCHEMBL5164148 0.87 F10 (0.65) F10PRSS1CYP1A2CYP2D6CYP2C9
SCHEMBL5164984 0.86 F10 (0.52) F10PRSS1MAPTKMT2AUSP2
SCHEMBL5165480 0.85 F10 (0.63) F10PRSS1MAPTKMT2ACYP1A2
SCHEMBL14408268 0.85 F10 (0.60) F10PRSS1MAPTKMT2ACYP1A2
SCHEMBL5164792 0.84 F10 (0.62) F10PRSS1MAPTKMT2ACYP1A2
SCHEMBL5164409 0.83 F10 (0.73) F10PRSS1KMT2ATSHRNPC1
SCHEMBL5165433 0.83 F10 (0.47) F10PRSS1MAPTKMT2AUSP2
SCHEMBL14408287 0.82 F10 (0.57) F10PRSS1MAPTKMT2ACYP1A2

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 88/4885MAPT 4360/4885

“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.