SCHEMBL18589488

SCHEMBL18589488

CCOC(=O)c1cn(Cc2cccc(O)c2)c2ccccc2c1=O

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
P2RX3 P56373 1/20 0.55
TP53 P04637 1/20 0.54
MAPT P10636 1/20 0.52
CHRNB2 P17787 1/20 0.51
CHRNA7 P36544 1/20 0.51
CHRNA4 P43681 1/20 0.51
CNR2 P34972 1/20 0.51
F2RL3 Q96RI0 1/20 0.51

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
SCHEMBL17347014 0.90 TP53 (0.57) LMNAP2RX3TP53MAPTCNR2
SCHEMBL15956289 0.89 LMNA (0.70) LMNAP2RX3TP53CNR2F2RL3
SCHEMBL1549401 0.88 P2RX3 (0.61) LMNAP2RX3TP53MAPTCNR2
SCHEMBL13762896 0.87 MAPT (0.69) LMNAP2RX3TP53MAPTCNR2
SCHEMBL17338605 0.85 P2RX3 (0.57) LMNAP2RX3TP53F2RL3
SCHEMBL18589532 0.84 LMNA (0.78) LMNATP53CNR2
SCHEMBL30125450 0.84 P2RX3 (0.61) LMNAP2RX3TP53MAPT
SCHEMBL16341783 0.82 CNR2 (0.63) LMNAP2RX3TP53CNR2F2RL3
SCHEMBL11895496 0.82 P2RX3 (0.62) LMNAP2RX3TP53F2RL3
SCHEMBL1548594 0.81 CHRM1 (0.76) LMNAP2RX3TP53MAPT

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-20170066722-A1 AGENTS FOR USE IN THE TREATMENT OF CARDIOVASCULAR AND INFLAMMATORY DISEASES STRUCTURALLY BASED ON 4(1 H)-QUINOLONE UCL BUSINESS PLC (GB) 2017-03-09 US disclosed
US-20170066722-A1 AGENTS FOR USE IN THE TREATMENT OF CARDIOVASCULAR AND INFLAMMATORY DISEASES STRUCTURALLY BASED ON 4(1 H)-QUINOLONE UCL BUSINESS PLC (GB) 2017-03-09 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-20170066722-A1 AGENTS FOR USE IN THE TREATMENT OF CARDIOVASCULAR AND INFLAMMATORY DISEASES STRUCTURALLY BASED ON 4(1 H)-QUINOLONE CBR3, AGTR1, CBR1 LMNA 565/4885P2RX3 345/4885TP53 3985/4885

“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.