SCHEMBL4875677

SCHEMBL4875677

O=C(O)c1cc2c(s1)c(-c1ccccc1)c(-c1ccc3nc(-c4c(F)cccc4F)ccc3c1)n2CC(=O)N1CCC(O)CC1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 2/20 0.34
GRM5 P41594 3/20 0.32
SMO Q99835 1/20 0.32
UBE2M P61081 1/20 0.32
DCUN1D1 Q96GG9 1/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MTOR P42345 2/20 0.32
PIK3CA P42336 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
MGLL Q99685 1/20 0.32
PKM P14618 1/20 0.32
SCN9A Q15858 2/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL4878029 0.90 SMO (0.34) SMOMAPTALDH1A1GAAKMT2A
SCHEMBL4875667 0.89 SMO (0.33) GRIN2BGRM5SMOUBE2MDCUN1D1
SCHEMBL4877128 0.89 LMNA (0.36) GRIN2BGRM5SMOUBE2MDCUN1D1
SCHEMBL4876599 0.88 DPP4 (0.33) MAPTRXFP1MGLL
SCHEMBL4877312 0.88 PIK3CA (0.43) SMOUBE2MDCUN1D1MAPTALDH1A1
SCHEMBL4877141 0.88 LMNA (0.36) SMOUBE2MDCUN1D1MAPTALDH1A1
SCHEMBL4866875 0.87 ALDH1A1 (0.39) MAPTALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL4872104 0.86 KDM4E (0.40) GRM5UBE2MDCUN1D1MAPTALDH1A1
SCHEMBL4868321 0.86 KCNH2 (0.38) GRIN2BGRM5SMOMTORPIK3CA
SCHEMBL4878306 0.86 PIK3CA (0.40) GRM5SMOMAPTMTORPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 GRIN2B 3420/4885GRM5 4042/4885SMO 4550/4885

“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.