SCHEMBL30747701

SCHEMBL30747701

O=C(O)c1cn(F)c2ccccc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
KDM4E B2RXH2 1/20 0.55
CHRM1 P11229 5/20 0.54
ALDH1A1 P00352 1/20 0.45
P2RX4 Q99571 1/20 0.45
GLA P06280 1/20 0.45
TP53 P04637 1/20 0.44

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
SCHEMBL7545236 1.00 LMNA (0.59) LMNAKDM4ECHRM1ALDH1A1P2RX4
Hydrochloric Acid SCHEMBL27329066 0.98 LMNA (0.57) LMNAKDM4ECHRM1ALDH1A1P2RX4
SCHEMBL27324947 0.95 LMNA (0.55) LMNAKDM4ECHRM1ALDH1A1P2RX4
Acetic Acid SCHEMBL27339243 0.95 LMNA (0.55) LMNAKDM4ECHRM1ALDH1A1P2RX4
Oxalic Acid SCHEMBL27853164 0.95 LMNA (0.55) LMNAKDM4ECHRM1ALDH1A1P2RX4
Sulfuric Acid SCHEMBL27334527 0.94 CHRM1 (0.56) LMNAKDM4ECHRM1
Toluene SCHEMBL27351014 0.92 LMNA (0.52) LMNAKDM4ECHRM1ALDH1A1TP53
SCHEMBL27419767 0.91 CHRM1 (0.54) LMNAKDM4ECHRM1
Lactic Acid SCHEMBL27348546 0.90 LMNA (0.50) LMNAKDM4ECHRM1
SCHEMBL785178 0.87 AKR1C3 (0.49) LMNAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11891385-B1 1-cyclopropyl-7-(4-((5-(3,5-dichlorobenzylideneamino)-2-thioxo-1,3,4-thiadiazol-3(2H)-yl)methyl)piperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic aci d as an anti-inflammatory compound King Faisal University (SA) 2024-02-06 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-11891385-B1 1-cyclopropyl-7-(4-((5-(3,5-dichlorobenzylideneamino)-2-thioxo-1,3,4-thiadiazol-3(2H)-yl)methyl)piperazin-1-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic aci d as an anti-inflammatory compound NFKBIA, IL1B, IL1A LMNA 4445/4885KDM4E 1674/4885CHRM1 1826/4885

“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.