SCHEMBL637014

SCHEMBL637014

COc1cc(C=O)ccc1OCC1CC1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.67
ALDH1A1 P00352 9/20 0.62
TSHR P16473 1/20 0.62
PDE4B Q07343 5/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
MAPT P10636 4/20 0.55
HTT P42858 2/20 0.55
LMNA P02545 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
HPGD P15428 2/20 0.51
POLB P06746 1/20 0.51
PDE4A P27815 1/20 0.51
PDE4C Q08493 1/20 0.51
PDE4D Q08499 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL30352601 0.94 ALDH1A1 (0.62) FDPSALDH1A1TSHRPDE4BSMN1; SMN2
SCHEMBL498127 0.94 ALDH1A1 (0.62) FDPSALDH1A1TSHRPDE4BSMN1; SMN2
SCHEMBL2843045 0.93 FDPS (0.61) FDPSALDH1A1TSHRPDE4BSMN1; SMN2
SCHEMBL6584890 0.90 ALDH1A1 (0.60) FDPSALDH1A1TSHRPDE4BSMN1; SMN2
SCHEMBL6584909 0.88 ALDH1A1 (0.58) FDPSALDH1A1TSHRPDE4BSMN1; SMN2
SCHEMBL9733843 0.87 ALDH1A1 (0.57) FDPSALDH1A1TSHRPDE4BSMN1; SMN2
SCHEMBL13232716 0.85 DRD2 (0.47) FDPSALDH1A1TSHRPDE4BSMN1; SMN2
SCHEMBL14799600 0.84 FDPS (0.47) FDPSALDH1A1TSHRPDE4BSMN1; SMN2
SCHEMBL19513039 0.84 POLB (0.58) ALDH1A1PDE4BSMN1; SMN2MAPTHTT
SCHEMBL17050362 0.83 PDE4B (0.46) FDPSALDH1A1TSHRPDE4BMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240383852-A1 ANTI-VIRAL COMPOUNDS Infex Therapeutics Limited (GB) 2024-11-21 US disclosed
EP-4305022-A1 ANTI-VIRAL COMPOUNDS Infex Therapeutics Limited (GB) 2024-01-17 EP disclosed
CN-117396462-A Antiviral compounds 英菲克斯治疗有限公司 2024-01-12 CN disclosed
WO-2022189810-A1 ANTI-VIRAL COMPOUNDS Infex Therapeutics Limited (GB) 2022-09-15 WO disclosed
EP-2283017-B1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS SA (CH) 2015-08-05 EP disclosed
US-8518955-B2 Fused pyrimidineone compounds as TRPV3 modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2013-08-27 US disclosed
EP-2626360-A1 Process for the preparation of fused pyrimidineone compounds useful as TRPV3 modulators Glenmark Pharmaceuticals S.A. (CH) 2013-08-14 EP disclosed
US-20120115886-A1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS S.A. 2012-05-10 US disclosed
US-20120108813-A1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS S.A. 2012-05-03 US disclosed
US-8119647-B2 Fused pyrimidineone compounds as TRPV3 modulators GLENMARK PHARMACEUTICALS S.A. (CH) 2012-02-21 US disclosed
EP-2283017-A1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2011-02-16 EP disclosed
US-20090286811-A1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS S.A. 2009-11-19 US disclosed
WO-2009130560-A1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2009-10-29 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 (4 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-20090286811-A1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS TRPV3, TRPV1, TRPV4 FDPS 523/4885ALDH1A1 3118/4885TSHR 3283/4885
US-20120115886-A1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS TRPV3, TRPV1, TRPV4 FDPS 523/4885ALDH1A1 3118/4885TSHR 3283/4885
US-20240383852-A1 ANTI-VIRAL COMPOUNDS PREP, DNPEP, PLP2 FDPS 2317/4885ALDH1A1 3785/4885TSHR 4579/4885
US-20120108813-A1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS TRPV3, TRPV1, TRPV4 FDPS 523/4885ALDH1A1 3118/4885TSHR 3283/4885

“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.