SCHEMBL14269727

SCHEMBL14269727

CCN(C)C(=O)C(=O)N(C)C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
TSHR P16473 3/20 0.36
NFKB1 P19838 1/20 0.36
THPO P40225 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 1/20 0.36
APEX1 P27695 1/20 0.36
PMP22 Q01453 1/20 0.36
CHRM1 P11229 1/20 0.32
LMNA P02545 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
SCHEMBL17704771 0.91 CHRM1 (0.36) ALDH1A1TSHRNFKB1THPOHSD17B10
SCHEMBL14098937 0.78 EPHX2 (0.38) ALDH1A1TSHRCHRM1
SCHEMBL7174331 0.78 CHRM1 (0.31) CHRM1
SCHEMBL188011 0.77 ALDH1A1 (0.50) ALDH1A1TSHRNFKB1THPOHSD17B10
SCHEMBL1369104 0.77 LMNA (0.42) ALDH1A1TSHRNFKB1THPOHSD17B10
SCHEMBL18211201 0.77
SCHEMBL209469 0.77
SCHEMBL28089025 0.74 ALDH1A1 (0.35) ALDH1A1TSHRNFKB1THPOHSD17B10
SCHEMBL13645779 0.74 TDP1 (0.33) ALDH1A1CHRM1
SCHEMBL6222518 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3483158-A1 HETEROCYCLIC COMPOUND SERVING AS FGFR4 INHIBITOR Hangzhou Innogate Pharma Co., Ltd. (CN) 2019-05-15 EP 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
US-20080045498-A1 POLYCYCLIC VIRAL INHIBITORS GENELABS TECHNOLOGIES, INC. 2008-02-21 US disclosed
US-20080045498-A1 POLYCYCLIC VIRAL INHIBITORS GENELABS TECHNOLOGIES, INC. 2008-02-21 US disclosed
WO-2008011521-A2 POLYCYCLIC VIRAL INHIBITORS GENELABS TECHNOLOGIES, INC. (US) 2008-01-24 WO disclosed
WO-2008008912-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2008-01-17 WO disclosed
WO-2008008907-A2 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2008-01-17 WO 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 (2 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-20080045498-A1 POLYCYCLIC VIRAL INHIBITORS EIF2AK2, ZC3HAV1, MAVS ALDH1A1 2784/4885TSHR 4802/4885NFKB1 1239/4885
US-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 ALDH1A1 1357/4885TSHR 4492/4885NFKB1 2054/4885

“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.