SCHEMBL4610205

SCHEMBL4610205

COC(=O)c1cccn1CC(=O)OC(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 3/20 0.39
NR1H2 P55055 1/20 0.39
FPR2 P25090 3/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
ALOX12 P18054 1/20 0.38
RECQL P46063 1/20 0.38
HDAC6 Q9UBN7 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL4915437 0.85 ALDH1A1 (0.43) ALDH1A1KDM4EFPR2KMT2AMAPT
SCHEMBL8266745 0.82 ALDH1A1 (0.58) GAAALDH1A1KDM4EKMT2AMAPT
SCHEMBL28509631 0.80 GAA (0.40) GAAALDH1A1KDM4EKMT2AMAPT
SCHEMBL9589872 0.80 ALDH1A1 (0.58) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL12391316 0.80 ALDH1A1 (0.42) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL31373551 0.78 ALDH1A1 (0.41) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL14164203 0.77 NR1H2 (0.47) ALDH1A1KDM4ENR1H2KMT2AMAPT
SCHEMBL11357348 0.76 NR4A2 (0.47) GAAALDH1A1KDM4EKMT2AMAPT
SCHEMBL10911266 0.76 MAPT (0.40) ALDH1A1KDM4EKMT2AMAPTMEN1
SCHEMBL15030294 0.75 KDM4E (0.42) ALDH1A1KDM4EFPR2KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112279848-A Pan-JAKs inhibitor and application thereof 四川海思科制药有限公司 2021-01-29 CN disclosed
US-20080227774-A1 5,5-DISUBSTITUTED-INDOLIZINONE COMPOUNDS ANADYS PHARMACEUTICALS, INC. 2008-09-18 US disclosed
EP-1910337-A2 HETEROARYL DERIVATIVES FOR TREATING VIRUSES GENELABS TECHNOLOGIES, INC. (US) 2008-04-16 EP disclosed
WO-2006138744-A2 HETEROARYL DERIVATIVES FOR TREATING VIRUSES GENELABS TECHNOLOGIES, INC. (US) 2006-12-28 WO 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-20080227774-A1 5,5-DISUBSTITUTED-INDOLIZINONE COMPOUNDS CYP3A5, IPO5, IDO1 GAA 2494/4885ALDH1A1 372/4885KDM4E 1369/4885

“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.