SCHEMBL4768319

SCHEMBL4768319

CCOC(=O)/C=C(/C)Nc1ccc(C)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.60
TDP1 Q9NUW8 1/20 0.50
DHODH Q02127 1/20 0.49
POLB P06746 1/20 0.49
ALDH1A1 P00352 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
LMNA P02545 3/20 0.48
HTT P42858 2/20 0.48
TP53 P04637 1/20 0.48
XBP1 P17861 1/20 0.48
MAPK1 P28482 1/20 0.48
AGTR1 P30556 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HSD17B10 Q99714 2/20 0.47
RECQL P46063 1/20 0.47
AURKA O14965 1/20 0.47
NTRK1 P04629 1/20 0.47
GAA P10253 2/20 0.46

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
SCHEMBL4768324 1.00 MAPT (0.60) MAPTTDP1DHODHPOLBALDH1A1
SCHEMBL11760780 0.95 MAPT (0.53) MAPTTDP1POLBALDH1A1SMN1; SMN2
SCHEMBL10862592 0.90 MAPT (0.58) MAPTTDP1ALDH1A1SMN1; SMN2LMNA
SCHEMBL10862595 0.90 MAPT (0.58) MAPTTDP1ALDH1A1SMN1; SMN2LMNA
SCHEMBL10860691 0.89 RAB9A (0.54) MAPTPOLBALDH1A1SMN1; SMN2LMNA
SCHEMBL10860698 0.89 RAB9A (0.54) MAPTPOLBALDH1A1SMN1; SMN2LMNA
SCHEMBL11721179 0.88 MAPT (0.53) MAPTALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL11721171 0.88 MAPT (0.53) MAPTALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL6825169 0.88 ALDH1A1 (0.59) MAPTTDP1ALDH1A1SMN1; SMN2LMNA
SCHEMBL6825162 0.88 ALDH1A1 (0.59) MAPTTDP1ALDH1A1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1613322-A4 AMINOQUINOLINE COMPOUNDS TAIGEN BIOTECHNOLOGY CO LTD (TW) 2008-08-13 EP disclosed
US-7183413-B2 Aminoquinoline compounds TAIGEN BIOTECHNOLOGY (TW) 2007-02-27 US disclosed
EP-1613322-A2 AMINOQUINOLINE COMPOUNDS Taigen Biotechnology (TW) 2006-01-11 EP disclosed
WO-2004091485-A2 AMINOQUINOLINE COMPOUNDS TAIGEN BIOTECHNOLOGY (TW) 2004-10-28 WO disclosed
US-20040209902-A1 e.g., 1,4-bis[2,6-dimethylquinolin-4ylamino]butane; used to treat inflammatory and immune diseases by binding to CXCR3 receptors. TAIGEN BIOTECHNOLOGY (TW) 2004-10-21 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-20040209902-A1 e.g., 1,4-bis[2,6-dimethylquinolin-4ylamino]butane; used to treat inflammatory and immune diseases by binding to CXCR3 receptors. CXCR3, CXCL10, CXCR1 MAPT 4134/4885TDP1 3240/4885DHODH 1563/4885

“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.