SCHEMBL15425995

SCHEMBL15425995

Cc1ccc(Br)c2[nH]cc(C(=O)c3ccc(F)cc3)c(=O)c12

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ BTK Q06187 1/20 0.36
▸ GRM5 P41594 1/20 0.36
▸ MAPK14 Q16539 1/20 0.34
▸ BRPF1 P55201 1/20 0.33
▸ GUSB P08236 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ HPD P32754 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ LTA4H P09960 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ CPB1 P15086 1/20 0.32

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
SCHEMBL12611200 0.84 ALDH1A1 (0.44) ALDH1A1LMNABTKSMN1; SMN2NPC1
SCHEMBL15425997 0.77 ALDH1A1 (0.45) ALDH1A1LMNAGRM5MAPK14BRPF1
SCHEMBL2035901 0.74 CLEC4M (0.55) ALDH1A1TP53MAPT
SCHEMBL12700469 0.70 ALDH1A1 (0.44) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL12610974 0.68 SMN1; SMN2 (0.51) ALDH1A1LMNASMN1; SMN2NPC1RAB9A
SCHEMBL2488117 0.68 CLEC4M (0.53) ALDH1A1TP53MAPT
SCHEMBL14104483 0.67 HSD17B10 (0.64) ALDH1A1LMNASMN1; SMN2RAB9ATP53
SCHEMBL17193970 0.66 MAPT (0.54) ALDH1A1NPC1NPSR1LTA4HMAPT
SCHEMBL20157554 0.66 MAPT (0.54) ALDH1A1LMNASMN1; SMN2NPC1TP53
SCHEMBL23884587 0.66 MAPT (0.50) LMNAGRM5MAPK14SMN1; SMN2NPC1

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-20140018384-A1 QUINOLINONE DERIVATIVES FOR USE IN THE TREATMENT OF AN AUTOIMMUNE DISEASE AND/OR AN INFLAMMATORY DISEASE PRONOXIS AB (SE) 2014-01-16 — — 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-20140018384-A1 QUINOLINONE DERIVATIVES FOR USE IN THE TREATMENT OF AN AUTOIMMUNE DISEASE AND/OR AN INFLAMMATORY DISEASE NOX4, NOX1, CYBB ALDH1A1 517/4885LMNA 3790/4885BTK 174/4885

“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.

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