SCHEMBL6280888

SCHEMBL6280888

CCOc1cc2c(cc1C=O)C(C(C)(C)C)=CCC2(C)C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.34
ERN1 O75460 2/20 0.32
POLB P06746 1/20 0.32
HNF4A P41235 2/20 0.32
RXRA P19793 2/20 0.32
GAA P10253 1/20 0.30
RARA P10276 1/20 0.30
RARB P10826 1/20 0.30
RARG P13631 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 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
SCHEMBL6283136 0.81 MAPT (0.35) ALDH1A1LMNAKMT2AHNF4ARXRA
SCHEMBL6275714 0.80 TSHR (0.47) ALDH1A1KDM4ELMNAKMT2AHNF4A
SCHEMBL6364097 0.80
SCHEMBL6279976 0.79 RXRA (0.35) KMT2AHNF4ARXRARARARARB
SCHEMBL6279970 0.79 RXRA (0.35) KMT2AHNF4ARXRARARARARB
SCHEMBL6283134 0.79 HNF4A (0.40) KDM4EKMT2AHNF4ARXRARARA
SCHEMBL6277660 0.78 HNF4A (0.34) KMT2AHNF4ARXRARARARARB
SCHEMBL6277657 0.78 HNF4A (0.34) KMT2AHNF4ARXRARARARARB
SCHEMBL6511957 0.78 KMT2A (0.35) ALDH1A1KDM4ELMNAKMT2AHNF4A
SCHEMBL6279257 0.77 KMT2A (0.32) KMT2AHNF4ARXRA

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-20050096380-A1 7-[(7-ALKOXY)-CHROM-3-EN-6-YL]-HEPTATRIENOIC ACID AND 7-[(3-ALKOXY)-5,6-DIHYDRONAPHTHALEN-2-YL]-HEPTATRIENOIC ACID DERIVATIVES HAVING SERUM GLUCOSE REDUCING ACTIVITY ALLERGAN, INC. 2005-05-05 US disclosed
US-6887896-B1 7-[(7-Alkoxy)-chrom-3-en-6-yl]-heptatrienoic acid and 7-[(3-alkoxy)-5,6-dihydronaphthalen-2-yl]-heptatrienoic acid derivatives having serum glucose reducing activity ALLERGAN, INC. (US) 2005-05-03 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-20050096380-A1 7-[(7-ALKOXY)-CHROM-3-EN-6-YL]-HEPTATRIENOIC ACID AND 7-[(3-ALKOXY)-5,6-DIHYDRONAPHTHALEN-2-YL]-HEPTATRIENOIC ACID DERIVATIVES HAVING SERUM GLUCOSE REDUCING ACTIVITY TPO, THRA, FABP6 ALDH1A1 529/4885KDM4E 2703/4885LMNA 2526/4885

“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.