SCHEMBL4879197

SCHEMBL4879197

Cc1nc(C)c(-c2ccc3cc(-c4c(-c5ccccc5)c5cc(C(=O)O)sc5n4CC(=O)N4CCOCC4)ccc3n2)s1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.39
TSHR P16473 4/20 0.39
ALDH1A1 P00352 4/20 0.39
POLB P06746 2/20 0.39
HSD17B10 Q99714 2/20 0.39
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
BRD4 O60885 1/20 0.38
CREBBP Q92793 1/20 0.38
RAB9A P51151 3/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 2/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.36
PTGS2 P35354 2/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL3931413 0.89 BRD4 (0.42) GRIN2BTSHRALDH1A1POLBHSD17B10
SCHEMBL4879187 0.86 KCNH2 (0.37) GRIN2BTSHRALDH1A1POLBHSD17B10
SCHEMBL4874715 0.83 BRD4 (0.38) GRIN2BTSHRPOLBKDM4ETP53
SCHEMBL4876223 0.83 GRIN2B (0.39) GRIN2BTSHRALDH1A1HSD17B10HPGD
SCHEMBL4876347 0.83 GRIN2B (0.39) GRIN2BTSHRALDH1A1HSD17B10HPGD
SCHEMBL3934917 0.82 GRIN2B (0.38) GRIN2BTSHRALDH1A1HSD17B10HPGD
SCHEMBL4878279 0.81 KCNH2 (0.35) GRIN2BBRD4CREBBPLMNAMAPT
SCHEMBL3938012 0.81 KCNH2 (0.35) GRIN2BTSHRHPGDBRD4CREBBP
SCHEMBL4866922 0.81 GRIN2B (0.36) GRIN2BTSHRALDH1A1POLBHSD17B10
SCHEMBL4873079 0.80 BRD4 (0.36) GRIN2BTP53BRD4CREBBPGAA

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 3420/4885TSHR 4492/4885ALDH1A1 1357/4885

“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.