SCHEMBL635622

SCHEMBL635622

O=Cc1ccccc1OCOCC1CCC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
HPGD P15428 2/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
SRC P12931 2/20 0.53
PTGDR2 Q9Y5Y4 1/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
HTR2C P28335 1/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.38
RAD52 P43351 1/20 0.38
PARP15 Q460N3 1/20 0.37
PARP10 Q53GL7 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
SCHEMBL4555928 0.97 SRC (0.57) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL3851835 0.84 SRC (0.63) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL29750488 0.82 ALDH1A1 (0.63) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL636591 0.82 ALDH1A1 (0.63) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL1276592 0.78 ALDH1A1 (0.79) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL30972130 0.78 ALDH1A1 (0.79) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL2817952 0.77 ALDH1A1 (0.56) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL7358514 0.76 ALDH1A1 (0.54) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL7358507 0.76 ALDH1A1 (0.54) ALDH1A1HPGDHTTSMN1; SMN2SRC
SCHEMBL4556262 0.76 ALDH1A1 (0.54) ALDH1A1HPGDHTTSMN1; SMN2SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (3 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 ALDH1A1 3118/4885HPGD 540/4885HTT 1988/4885
US-20120115886-A1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS TRPV3, TRPV1, TRPV4 ALDH1A1 3118/4885HPGD 540/4885HTT 1988/4885
US-20120108813-A1 FUSED PYRIMIDINEONE COMPOUNDS AS TRPV3 MODULATORS TRPV3, TRPV1, TRPV4 ALDH1A1 3118/4885HPGD 540/4885HTT 1988/4885

“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.