SCHEMBL4876386

SCHEMBL4876386

CC1CCCN1C(=O)Cn1c(-c2ccc3nc(-c4ccccc4C(F)(F)F)ccc3c2)c(C2CCCCC2)c2sc(C(=O)O)cc21

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.35
MAPK1 P28482 3/20 0.33
KCNH2 Q12809 3/20 0.33
HRH3 Q9Y5N1 3/20 0.33
ALDH1A1 P00352 3/20 0.33
POLB P06746 2/20 0.33
TSHR P16473 2/20 0.33
KDM4E B2RXH2 2/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33
USP2 O75604 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
RORC P51449 3/20 0.32

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
SCHEMBL4876396 0.91 KCNH2 (0.36) MAPTMAPK1KCNH2HRH3ALDH1A1
SCHEMBL4878059 0.90 KDM4E (0.38) MAPTMAPK1KCNH2HRH3ALDH1A1
SCHEMBL4876060 0.88 ALDH1A1 (0.40) MAPTMAPK1KCNH2HRH3ALDH1A1
SCHEMBL4878273 0.87 KCNH2 (0.34) MAPTMAPK1KCNH2HRH3ALDH1A1
SCHEMBL4865027 0.87 MAPT (0.33) MAPTMAPK1KCNH2HRH3ALDH1A1
SCHEMBL4875205 0.87 IRAK4 (0.36) ALDH1A1POLBTSHRTP53KMT2A
SCHEMBL4878855 0.86 MAPT (0.34) MAPTMAPK1KCNH2HRH3ALDH1A1
SCHEMBL4877495 0.86 KCNH2 (0.34) MAPTMAPK1KCNH2HRH3ALDH1A1
SCHEMBL4875350 0.85 NPC1 (0.34) MAPTKCNH2HRH3ALDH1A1TP53
SCHEMBL4875594 0.85 KCNH2 (0.44) MAPTKCNH2HRH3POLBUSP2

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 MAPT 4372/4885MAPK1 4078/4885KCNH2 2647/4885

“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.