SCHEMBL14927114

SCHEMBL14927114

COc1cc(-c2cc3cc(C)c(C)c(OC)c3c(C)n2)cc(OCc2ccccc2)c1OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ STAT3 P40763 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ MAPT P10636 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ ABCB1 P08183 2/20 0.38
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE4D Q08499 1/20 0.38
▸ MAP3K11 Q16584 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ CDK1 P06493 1/20 0.37

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
SCHEMBL9985150 0.90 HTT (0.44) HTTSMN1; SMN2STAT3ALDH1A1MAPT
SCHEMBL128876 0.79 MEN1 (0.44) SMN1; SMN2ALDH1A1MAPTHPGDKDM4E
SCHEMBL129941 0.78 RAC1 (0.43) SMN1; SMN2ALDH1A1MAPTKDM4ELMNA
SCHEMBL14927116 0.77 RAC1 (0.42) ALDH1A1MAPTKDM4EPDGFRBHSD17B10
SCHEMBL9985577 0.76 NPC1 (0.51) HTTSMN1; SMN2STAT3MAPTKDM4E
SCHEMBL14927115 0.74 KMT2A (0.35) HTTSMN1; SMN2ALDH1A1MAPTHPGD
SCHEMBL151888 0.72 SLC10A2 (0.46) SMN1; SMN2ALDH1A1MAPTHPGDKDM4E
SCHEMBL14927117 0.72 SLC10A2 (0.44) MAPTKDM4EMAP3K11L3MBTL1PDGFRB
SCHEMBL12071572 0.71 TLR8 (0.43) ALDH1A1CYP3A4KDM4EHSD17B10
SCHEMBL14927023 0.70 FYN (0.41) SMN1; SMN2ALDH1A1HPGDKDM4ELMNA

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-8933096-B2 Antimicrobial agents Rugers, The State University of New Jersey (US) 2015-01-13 — — US disclosed
US-20130116278-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2013-05-09 — — 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-20130116278-A1 ANTIMICROBIAL AGENTS MRPL21, ARG1, RPP30 HTT 3827/4885SMN1; SMN2 3496/4885STAT3 2495/4885

“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.

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