SCHEMBL2820699

SCHEMBL2820699

COCC(C)Oc1ccccc1C=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
HPGD P15428 1/20 0.55
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
LMNA P02545 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
MCHR1 Q99705 1/20 0.44
KMT2A Q03164 3/20 0.43
GAA P10253 1/20 0.43
DHFR P00374 2/20 0.43
DCPS Q96C86 2/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
TLR2 O60603 1/20 0.41
ERN1 O75460 1/20 0.41

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
SCHEMBL19519745 0.84 MCHR1 (0.44) ALDH1A1HPGDHTTSMN1; SMN2LMNA
SCHEMBL11673199 0.83 ALDH1A1 (0.53) ALDH1A1HPGDHTTSMN1; SMN2LMNA
SCHEMBL8940216 0.81 ALDH1A1 (0.52) ALDH1A1HPGDHTTSMN1; SMN2LMNA
SCHEMBL10746717 0.81 ALDH1A1 (0.52) ALDH1A1HPGDHTTSMN1; SMN2LMNA
SCHEMBL11323988 0.80 ALDH1A1 (0.53) ALDH1A1HPGDHTTSMN1; SMN2LMNA
SCHEMBL28935895 0.80 ALDH1A1 (0.50) ALDH1A1HPGDHTTSMN1; SMN2LMNA
SCHEMBL11267013 0.79 ALDH1A1 (0.49) ALDH1A1HPGDHTTSMN1; SMN2LMNA
SCHEMBL177279 0.78 ALDH1A1 (0.55) ALDH1A1HPGDHTTSMN1; SMN2LMNA
SCHEMBL15060240 0.78 ADRA2A (0.42) ALDH1A1HPGDHTTSMN1; SMN2LMNA
SCHEMBL29165171 0.78 ALDH1A1 (0.47) ALDH1A1HPGDHTTSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8349846-B2 Fused pyrimidine derivatives as TRPV3 modulators GLENMARK PHARMACEUTICALS, S.A. (CH) 2013-01-08 US disclosed
US-20100292254-A1 Fused Pyrimidine Derivatives as Trpv3 Modulators GLENMARK PHARMACEUTICALS, S.A. (CH) 2010-11-18 US disclosed
EP-2229388-A2 FUSED PYRIMIDINE DERIVATIVES AS TRPV3 MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2010-09-22 EP disclosed
WO-2009109987-A2 FUSED PYRIMIDINE DERIVATIVES AS TRPV3 MODULATORS GLENMARK PHARMACEUTICALS, S.A. (CH) 2009-09-11 WO disclosed
US-7360883-B2 Active ray curable ink, image forming method and ink-jet recording apparatus KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-04-22 US disclosed
US-20050190252-A1 Active ray curable ink, image forming method and ink-jet recording apparatus KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2005-09-01 US 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-20100292254-A1 Fused Pyrimidine Derivatives as Trpv3 Modulators TRPV3, TRPV1, TRPV5 ALDH1A1 4233/4885HPGD 1055/4885HTT 3087/4885

“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.