SCHEMBL4875667

SCHEMBL4875667

O=C(O)c1cc2c(s1)c(C1CCCCC1)c(-c1ccc3nc(-c4c(F)cccc4F)ccc3c1)n2CC(=O)N1CCC(O)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMO Q99835 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRM5 P41594 1/20 0.32
CYP2D6 P10635 1/20 0.31
HRH1 P35367 1/20 0.31
UBE2M P61081 1/20 0.30
DCUN1D1 Q96GG9 1/20 0.30
MDM2 Q00987 1/20 0.30
MAPT P10636 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL4868332 0.95 ALDH1A1 (0.37) SMOALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4877463 0.93 GAA (0.36) SMOALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4876592 0.91 DPP4 (0.32) ALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4875677 0.89 GRIN2B (0.34) SMOALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4878001 0.89 ALDH1A1 (0.34) SMOALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4877120 0.88 ALDH1A1 (0.34) SMOALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4877145 0.88 GRIN2B (0.37) SMOALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4877302 0.87 PIK3CA (0.39) SMOALDH1A1UBE2MDCUN1D1MAPT
SCHEMBL4877132 0.87 MAPT (0.35) SMOALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4877464 0.87 CYP2D6 (0.34) GRIN2BCYP2D6HRH1MDM2MAPT

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 SMO 4550/4885ALDH1A1 1357/4885GAA 66/4885

“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.