SCHEMBL4879012

SCHEMBL4879012

O=C(O)c1cc2c(s1)c(C1CCCCC1)c(-c1ccc3nc(-c4ccc(F)cc4)ccc3c1)n2Cc1ccncc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.35
CYP2D6 P10635 3/20 0.34
HRH1 P35367 3/20 0.34
MAPK14 Q16539 1/20 0.34
GRM2 Q14416 2/20 0.34
RIPK3 Q9Y572 1/20 0.34
KCNH2 Q12809 2/20 0.33
MAPT P10636 1/20 0.33
NAMPT P43490 1/20 0.33
PDE5A O76074 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
MCHR1 Q99705 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
SCHEMBL4873267 0.93 ALOX5AP (0.34) ALOX5APCYP2D6HRH1GRM2MAPT
SCHEMBL4866901 0.93 GRIN1 (0.33) ALOX5APKCNH2PDE5AHRH3
SCHEMBL4875175 0.91 ERCC5 (0.38) ALOX5APKCNH2PDE5AMAOAMAOB
SCHEMBL4868085 0.89 F10 (0.33) ALOX5APMCHR1
SCHEMBL4872012 0.89 MDM2 (0.35) ALOX5AP
SCHEMBL4877200 0.88 KDM4E (0.33) ALOX5APKCNH2MAPTHRH3
SCHEMBL4867590 0.87 ALOX5AP (0.35) ALOX5AP
SCHEMBL4872478 0.87 KCNH2 (0.39) KCNH2HRH3
SCHEMBL4878872 0.87 LMNA (0.37) ALOX5APCYP2D6MAPT
SCHEMBL4878276 0.87 MAOA (0.36) ALOX5APMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 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-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 ALOX5AP 3943/4885CYP2D6 1327/4885HRH1 3900/4885

“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.