SCHEMBL4375015

SCHEMBL4375015

C=C(C)/C=C(\CC)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
FFAR3 O14843 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TSHR P16473 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ABAT P80404 1/20 0.32
GRIK1 P39086 2/20 0.31
GRIK2 Q13002 2/20 0.31
TET2 Q6N021 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
SCHEMBL4375017 1.00 ALDH1A1 (0.35) ALDH1A1FFAR3TDP1TSHRKDM4E
SCHEMBL6871163 0.82 ALDH1A1 (0.33) ALDH1A1FFAR3TDP1TSHRKDM4E
SCHEMBL5595771 0.81 FFAR3 (0.35) ALDH1A1FFAR3TSHRKDM4EGRIK1
SCHEMBL18169351 0.81 FFAR3 (0.35) ALDH1A1FFAR3TSHRKDM4EGRIK1
SCHEMBL20109820 0.80 ALDH1A1 (0.38) ALDH1A1FFAR3TDP1TSHRKDM4E
SCHEMBL1977289 0.80 ALDH1A1 (0.38) ALDH1A1FFAR3TDP1TSHRKDM4E
SCHEMBL4273874 0.79 TSHR (0.33) ALDH1A1FFAR3TSHRKDM4EABAT
SCHEMBL2308752 0.79 TSHR (0.33) ALDH1A1FFAR3TSHRKDM4EGRIK1
SCHEMBL29373734 0.79 TSHR (0.33) ALDH1A1FFAR3TSHRKDM4EGRIK1
SCHEMBL28183840 0.79 KDM4E (0.43) TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070021427-A1 Novel tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2007-01-25 US claimed
US-7622612-B2 Tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2009-11-24 US disclosed
US-20070021427-A1 Novel tricyclic derivatives and their use CHEMTECH RESEARCH INCORPORATION (KR) 2007-01-25 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-20070021427-A1 Novel tricyclic derivatives and their use NFATC1, IL2, CCL2 ALDH1A1 2078/4885FFAR3 3784/4885TDP1 993/4885

“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.