SCHEMBL17267602

SCHEMBL17267602

CC(C)(C)OC(=O)N1C=C(O)C=CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.38
PREP P48147 1/20 0.35
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
NR1H2 P55055 1/20 0.34
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
BCHE P06276 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
PDK4 Q16654 1/20 0.32
ELANE P08246 1/20 0.32
GPR119 Q8TDV5 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL28970107 0.81 PREP (0.36) ESR2PREPUSP2SMN1; SMN2ALDH1A1
SCHEMBL5697477 0.78 NR1H2 (0.39) ESR2PREPUSP2SMN1; SMN2ALDH1A1
SCHEMBL3110330 0.75 MAPT (0.36) ESR2PREPUSP2SMN1; SMN2ALDH1A1
SCHEMBL31084285 0.75 NR1H2 (0.35) ESR2USP2SMN1; SMN2ALDH1A1LMNA
SCHEMBL8120965 0.75 ESR2 (0.38) ESR2USP2SMN1; SMN2MAPTNR1H2
SCHEMBL2980997 0.74 ESR2 (0.43) ESR2USP2SMN1; SMN2ALDH1A1LMNA
SCHEMBL7484898 0.73 GPR119 (0.34) ESR2USP2SMN1; SMN2ALDH1A1LMNA
SCHEMBL3505154 0.73 ESR2 (0.45) ESR2USP2SMN1; SMN2NR1H2BCHE
SCHEMBL1838102 0.70 PREP (0.37) ESR2PREPUSP2SMN1; SMN2ALDH1A1
SCHEMBL15414407 0.70 PREP (0.40) ESR2PREPUSP2SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3120852-B1 PREVENTIVE AND/OR THERAPEUTIC AGENT FOR IMMUNE DISEASES TAIHO PHARMACEUTICAL CO LTD (JP) 2019-05-01 EP disclosed
EP-2947086-B1 NOVEL FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2018-01-03 EP disclosed
US-9782412-B2 Preventive and/or therapeutic agent of immune disease TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-10-10 US disclosed
US-9580432-B2 Fused pyrimidine compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-02-28 US disclosed
US-20170042900-A1 PREVENTIVE AND/OR THERAPEUTIC AGENT OF IMMUNE DISEASE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2017-02-16 US disclosed
EP-3120852-A1 PROPHYLACTIC AND/OR THERAPEUTIC AGENT FOR IMMUNE DISEASES Taiho Pharmaceutical Co., Ltd. (JP) 2017-01-25 EP disclosed
US-20160115168-A1 NOVEL FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2016-04-28 US disclosed
EP-2947086-A1 NOVEL FUSED PYRIMIDINE COMPOUND OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2015-11-25 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 (2 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-20170042900-A1 PREVENTIVE AND/OR THERAPEUTIC AGENT OF IMMUNE DISEASE BTK, SYK, MYD88 ESR2 3657/4885PREP 2816/4885USP2 3046/4885
US-20160115168-A1 NOVEL FUSED PYRIMIDINE COMPOUND OR SALT THEREOF BTK, JAK2, SYK ESR2 4401/4885PREP 4516/4885USP2 4291/4885

“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.