SCHEMBL5212252

SCHEMBL5212252

COC(=O)CCc1oc(-c2ccc(OC)cc2)nc1-c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
GAA P10253 4/20 0.47
KDR P35968 1/20 0.46
TARBP2 Q15633 2/20 0.46
ALDH1A1 P00352 7/20 0.46
HPGD P15428 3/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPK1 P28482 1/20 0.46
VDR P11473 1/20 0.46
PPARD Q03181 1/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.44
CETP P11597 1/20 0.44
TP53 P04637 1/20 0.44
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL5211537 0.90 RXRA (0.47) MAPTGAAKDRTARBP2ALDH1A1
SCHEMBL5212957 0.89 IKBKB (0.47) MAPTGAAKDRTARBP2ALDH1A1
SCHEMBL5209458 0.89 LMNA (0.44) MAPTTARBP2ALDH1A1HSD17B10LMNA
SCHEMBL5208765 0.86 MAPT (0.51) MAPTGAAALDH1A1HPGDVDR
SCHEMBL5207499 0.86 CCNC (0.48) MAPTGAAALDH1A1VDRPPARD
SCHEMBL1362553 0.83 CYP11B1 (0.43) MAPTGAATARBP2ALDH1A1MEN1
SCHEMBL13116220 0.82 PTGDR2 (0.58) KDRTARBP2ALDH1A1HPGDHSD17B10
SCHEMBL10833120 0.82 ALDH1A1 (0.43) MAPTGAATARBP2ALDH1A1HSD17B10
SCHEMBL5211259 0.81 FAAH (0.44) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL5209323 0.81 MAPT (0.41) MAPTGAAALDH1A1HPGDHSD17B10

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-7183276-B2 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-27 US disclosed
US-20050090534-A1 Azole compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-04-28 US disclosed
EP-1486490-A1 AZOLE COMPOUNDS Takeda Chemical Industries, Ltd. (JP) 2004-12-15 EP 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-20050090534-A1 Azole compounds AHR, NR0B2, NR2C2 MAPT 3958/4885GAA 4803/4885KDR 961/4885

“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.