SCHEMBL6022771

SCHEMBL6022771

CCCCCCCCCc1cc(C(=O)C=CN2CCN(CC(O)c3cccc(OC)c3)CC2)cc(CCCCCCCCC)c1O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.41
IGF1R P08069 1/20 0.39
SPHK1 Q9NYA1 1/20 0.38
TP53 P04637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
GPR52 Q9Y2T5 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.35
UGCG Q16739 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
SCHEMBL6023970 0.88 GRIN2B (0.40) GRIN2BIGF1RSPHK1TP53ALDH1A1
SCHEMBL6023116 0.86 SPHK1 (0.41) GRIN2BIGF1RSPHK1TP53L3MBTL1
SCHEMBL6022765 0.84 ALDH1A1 (0.44) GRIN2BGPR52KDM4EALDH1A1MAPT
SCHEMBL6022772 0.82 KDM4E (0.46) IGF1RTP53KDM4E
SCHEMBL6023913 0.78 ADRB2 (0.40) IGF1RSPHK1ADRB2ADRB1ADRB3
SCHEMBL6023156 0.77 USP2 (0.42) IGF1RSPHK1ADRB2ADRB1ADRB3
SCHEMBL6023543 0.73 KMT2A (0.40) SPHK1ADRB2ADRB1ADRB3ADRA1D
SCHEMBL6022956 0.73 SPHK1 (0.38) IGF1RSPHK1ADRB2ADRB1ADRB3
SCHEMBL6023503 0.72 KDM4E (0.39) IGF1RSPHK1KDM4E
SCHEMBL6022920 0.72 KDM4E (0.39) IGF1RSPHK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7078407-B2 4-hydroxycinnamamide derivatives as antioxidants and pharmaceutical compositions containing them KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2006-07-18 US disclosed
US-20030162789-A1 4-Hydroxycinnamamide derivatives as antioxidants and pharmaceutical compositions containing them KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2003-08-28 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-20030162789-A1 4-Hydroxycinnamamide derivatives as antioxidants and pharmaceutical compositions containing them HTT, PARK7, NQO1 GRIN2B 2261/4885IGF1R 3646/4885SPHK1 3832/4885

“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.