SCHEMBL5165474

SCHEMBL5165474

Cc1cc(NC(=O)C(Cc2cccc(CN)c2)c2ccccc2F)ccc1N1CCCCC1=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNQ2 O43526 1/20 0.41
ROCK2 O75116 1/20 0.38
F10 P00742 10/20 0.37
PRSS1 P07477 2/20 0.37
PRSS2 P07478 2/20 0.37
PRSS3 P35030 2/20 0.37
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
MAPT P10636 2/20 0.34
GAA P10253 1/20 0.34
TP53 P04637 1/20 0.34
MGAT2 Q10469 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
Hydrochloric Acid SCHEMBL27583896 0.99 KCNQ2 (0.41) KCNQ2ROCK2F10PRSS1PRSS2
SCHEMBL5165466 0.98 KCNQ2 (0.40) KCNQ2ROCK2F10PRSS1PRSS2
Hydrochloric Acid SCHEMBL27601440 0.97 KCNQ2 (0.40) KCNQ2ROCK2F10PRSS1PRSS2
SCHEMBL5165776 0.91 KCNQ2 (0.40) KCNQ2ROCK2F10LMNAHPGD
Hydrochloric Acid SCHEMBL27601421 0.90 KCNQ2 (0.39) KCNQ2ROCK2F10LMNAHPGD
SCHEMBL5165774 0.89 F10 (0.42) KCNQ2ROCK2F10MAPTTP53
Hydrochloric Acid SCHEMBL27601429 0.88 F10 (0.42) KCNQ2ROCK2F10MAPTTP53
SCHEMBL5163827 0.88 F10 (0.47) KCNQ2ROCK2F10PRSS1PRSS2
SCHEMBL5164612 0.87 F10 (0.44) KCNQ2F10PRSS1PRSS2PRSS3
Hydrochloric Acid SCHEMBL27583899 0.87 F10 (0.46) KCNQ2ROCK2F10PRSS1PRSS2

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 7 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
CN-1518541-A Phenyl derivatives Ĭ��ר���ɷ����޹�˾ 2004-08-04 CN 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 KCNQ2 2064/4885ROCK2 2806/4885F10 6/4885

“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.