SCHEMBL17467946

SCHEMBL17467946

CCC(O)C(O)C(CO)CO

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.50
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 3/20 0.38
TSHR P16473 3/20 0.35
KDM4E B2RXH2 3/20 0.33
CNR1 P21554 1/20 0.31
ADRA1A P35348 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL17464898 0.83 LMNA (0.41) LMNAL3MBTL1TDP1TSHR
SCHEMBL940429 0.81
SCHEMBL9068604 0.81 LMNA (0.50) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL7153546 0.80 LMNA (0.54) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL13296276 0.79 LMNA (0.59) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL17528489 0.79 LMNA (0.69) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL14147720 0.79 LMNA (0.69) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL9507409 0.79 LMNA (0.59) LMNAL3MBTL1TDP1TSHRKDM4E
SCHEMBL155021 0.79
SCHEMBL3953293 0.79 LMNA (0.59) LMNAL3MBTL1TDP1TSHRKDM4E

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-20170298058-A1 HETEROCYCLIC RING AND CARBOCYCLIC DERIVATIVE SHIONOGI & CO (JP) 2017-10-19 US disclosed
US-9550763-B2 Heterocyclic ring and carbocyclic derivative SHIONOGI & CO., LTD. (JP) 2017-01-24 US disclosed
US-20160024072-A1 Heterocyclic Ring and Carbocyclic Derivative SHIONOGI & CO., LTD. (JP) 2016-01-28 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 (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-20170298058-A1 HETEROCYCLIC RING AND CARBOCYCLIC DERIVATIVE P2RX3, P2RX7, P2RX2 LMNA 3635/4885L3MBTL1 4046/4885TDP1 4738/4885
US-20160024072-A1 Heterocyclic Ring and Carbocyclic Derivative P2RX3, P2RX7, P2RX2 LMNA 3635/4885L3MBTL1 4046/4885TDP1 4738/4885

“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.