SCHEMBL5204511

SCHEMBL5204511

CCOC(=O)c1ccc(-c2ccc(-c3ccc(C(F)(F)F)cc3)n2C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.53
KDM4E B2RXH2 2/20 0.48
HSP90AA1 P07900 2/20 0.48
MEN1 O00255 1/20 0.48
CRHBP P24387 1/20 0.48
KMT2A Q03164 1/20 0.48
CRHR2 Q13324 1/20 0.48
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
ESR1 P03372 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
ESR2 Q92731 1/20 0.46
CA14 Q9ULX7 1/20 0.46
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAOA P21397 1/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL2294507 0.87 MAPT (0.57) MAPTKDM4EHSP90AA1MEN1CRHBP
SCHEMBL5206706 0.86 CA12 (0.46) MAPTKDM4EHSP90AA1CA12CA1
SCHEMBL668192 0.85 CA12 (0.61) MAPTKDM4EHSP90AA1MEN1CRHBP
SCHEMBL31710561 0.83 MAPT (0.45) MAPTKDM4EHSP90AA1MEN1CRHBP
SCHEMBL5207654 0.80 SRD5A2 (0.59) BACE1
SCHEMBL5203063 0.80 MAPT (0.63) MAPTKDM4EHSP90AA1MEN1CRHBP
SCHEMBL5207670 0.80 PRF1 (0.56) MAPTKDM4EHSP90AA1MEN1CRHBP
SCHEMBL11879298 0.79 KDM4E (0.43) MAPTKDM4EHSP90AA1MEN1CRHBP
SCHEMBL16664045 0.79 CA12 (0.53) MAPTKDM4EHSP90AA1MEN1CRHBP
Oxirane SCHEMBL958736 0.79 CA12 (0.53) MAPTKDM4EHSP90AA1MEN1CRHBP

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-7223791-B2 Function regulator for retinoid relative receptor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-05-29 US disclosed
US-20040157881-A1 Function regulator for retinoid relative receptor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-08-12 US disclosed
EP-1405636-A1 FUNCTION REGULATOR FOR RETINOID RELATIVE RECEPTOR Takeda Chemical Industries, Ltd. (JP) 2004-04-07 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-20040157881-A1 Function regulator for retinoid relative receptor RXRA, RARA, RARG MAPT 4855/4885KDM4E 2371/4885HSP90AA1 2965/4885

“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.