SCHEMBL2977349

SCHEMBL2977349

C1CCC(=C2CCC3(CC2)OCCO3)CC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
HPGD P15428 3/20 0.33
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.31
HRH3 Q9Y5N1 1/20 0.30
KMT2A Q03164 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL16769010 0.97 KDM4E (0.32) ALDH1A1HPGDKDM4EUSP2
SCHEMBL17147797 0.92 KDM4E (0.32) ALDH1A1KDM4EKMT2A
SCHEMBL2650564 0.87 POLB (0.31) KDM4EHTT
SCHEMBL16769009 0.76 KDM4E (0.31) ALDH1A1KDM4EKMT2A
SCHEMBL6243755 0.73 ALDH1A1 (0.36) ALDH1A1HPGDKDM4EUSP2
SCHEMBL8603903 0.73 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EUSP2KMT2A
SCHEMBL60409 0.72 KDM4E (0.33) ALDH1A1HPGDKDM4E
SCHEMBL6469498 0.72 KDM4E (0.33) ALDH1A1HPGDKDM4E
SCHEMBL6245109 0.72 KDM4E (0.33) ALDH1A1HPGDKDM4E
SCHEMBL13276440 0.72 KDM4E (0.33) ALDH1A1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767854-B2 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2010-08-03 US disclosed
US-20090082463-A1 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-03-26 US disclosed
EP-1884510-A1 N-SUBSTITUTED PHENYLACETAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Dainippon Sumitomo Pharma Co., Ltd. (JP) 2008-02-06 EP disclosed
US-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 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 (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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 ALDH1A1 3841/4885HPGD 3433/4885KDM4E 4301/4885
US-20090082463-A1 N-substituted phenylacetamide derivative and pharmaceutical composition containing the same HRH4, HRH2, CNR2 ALDH1A1 321/4885HPGD 163/4885KDM4E 2693/4885

“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.