SCHEMBL9980434

SCHEMBL9980434

CC(C(=O)OC(C)(C)C)c1cnccn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.39
LMNA P02545 2/20 0.38
KMT2A Q03164 1/20 0.38
KDM4D Q6B0I6 1/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGDS O60760 1/20 0.34
NAPRT Q6XQN6 1/20 0.34
HCAR2 Q8TDS4 1/20 0.34
APP P05067 1/20 0.34
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
TSHR P16473 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
SCHEMBL14776438 0.81 HPGDS (0.41) LMNAKDM4EHPGDSNAPRTHCAR2
SCHEMBL30416431 0.80 GPR119 (0.36) GPR119LMNAKMT2AKDM4DKDM4E
SCHEMBL27691754 0.79 LMNA (0.43) GPR119LMNAKMT2AKDM4DKDM4E
SCHEMBL17444316 0.79 SMN1; SMN2 (0.44) GPR119LMNAKMT2AKDM4DKDM4E
SCHEMBL11680658 0.79 SMN1; SMN2 (0.42) GPR119LMNAKMT2AKDM4ERAB9A
SCHEMBL10387749 0.78 KDM4E (0.41) LMNAKDM4ENAPRTHCAR2RAB9A
SCHEMBL14660006 0.77 CYP1A2 (0.53) GPR119LMNAKMT2AKDM4EMAPT
SCHEMBL27557993 0.77 LMNA (0.44) LMNAKMT2AKDM4EHPGDSNAPRT
SCHEMBL11983421 0.75 LMNA (0.43) LMNAKMT2AKDM4EHPGDSNAPRT
SCHEMBL6037597 0.75 LMNA (0.51) LMNAKDM4EHPGDSNAPRTHCAR2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365574-B2 Soluble guanylate cyclase activators MERCK SHARP & DOHME CORP. (US) 2016-06-14 US disclosed
EP-2575473-B1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME (US) 2016-01-20 EP disclosed
EP-2575473-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS Merck Sharp & Dohme Corp. (US) 2013-04-10 EP disclosed
US-20130072492-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME LLC 2013-03-21 US disclosed
WO-2011149921-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME CORP. (US) 2011-12-01 WO 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-20130072492-A1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS GUCY1A2, GUCY1A1, PDE2A GPR119 162/4885LMNA 1367/4885KMT2A 4728/4885

“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.