SCHEMBL3143409

SCHEMBL3143409

Oc1ccc2c3c(oc2c1)CCCC3

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.74
CYP3A4 P08684 1/20 0.74
CYP2C19 P33261 1/20 0.74
KDM4E B2RXH2 5/20 0.68
ALDH1A1 P00352 5/20 0.68
HSD17B10 Q99714 3/20 0.68
GLA P06280 3/20 0.68
GAA P10253 3/20 0.68
HPGD P15428 3/20 0.68
CASP1 P29466 2/20 0.68
CASP7 P55210 2/20 0.68
TSHR P16473 1/20 0.68
MAOA P21397 5/20 0.63
LMNA P02545 3/20 0.55
MAPT P10636 2/20 0.55
ALOX15 P16050 1/20 0.55
HTT P42858 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
MAOB P27338 3/20 0.47
HSD17B3 P37058 2/20 0.46

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
SCHEMBL4395752 0.85 CYP1A2 (1.00) CYP1A2CYP3A4CYP2C19KDM4EALDH1A1
SCHEMBL30392254 0.85 CYP1A2 (1.00) CYP1A2CYP3A4CYP2C19KDM4EALDH1A1
SCHEMBL8870570 0.84 CYP1A2 (0.96) CYP1A2CYP3A4CYP2C19KDM4EALDH1A1
SCHEMBL30465069 0.81 KDM4E (1.00) CYP1A2KDM4EALDH1A1HSD17B10GLA
SCHEMBL3768560 0.81 KDM4E (1.00) CYP1A2KDM4EALDH1A1HSD17B10GLA
SCHEMBL3762769 0.80 CYP1A2 (1.00) CYP1A2KDM4EALDH1A1HSD17B10GLA
SCHEMBL3625077 0.80 CYP1A2 (1.00) CYP1A2KDM4EALDH1A1HSD17B10GLA
SCHEMBL21140708 0.78 MAOA (0.53) CYP1A2CYP3A4CYP2C19KDM4EALDH1A1
SCHEMBL3757463 0.77 MAOA (1.00) CYP1A2KDM4EALDH1A1HSD17B10GLA
SCHEMBL10187520 0.75 CYP1A2 (0.47) CYP1A2CYP3A4CYP2C19KDM4EALDH1A1

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-2137193-B1 SUBSTITUTED DIHYDRO AND TETRAHYDRO OXAZOLOPYRIMIDINONES, PREPARATION AND USE THEREOF SANOFI SA (FR) 2017-08-09 EP disclosed
US-8642603-B2 Substituted dihydro and tetrahydro oxazolopyrimidinones, preparation and use thereof SANOFI (FR) 2014-02-04 US disclosed
US-20100075994-A1 SUBSTITUTED DIHYDRO AND TETRAHYDRO OXAZOLOPYRIMIDINONES, PREPARATION AND USE THEREOF SANOFI-AVENTIS (FR) 2010-03-25 US disclosed
EP-2137193-A2 SUBSTITUTED DIHYDRO AND TETRAHYDRO OXAZOLOPYRIMIDINONES, PREPARATION AND USE THEREOF Sanofi-Aventis (FR) 2009-12-30 EP disclosed
WO-2008112483-A2 SUBSTITUTED DIHYDRO AND TETRAHYDRO OXAZOLOPYRIMIDINONES, PREPARATION AND USE THEREOF SANOFI-AVENTIS (FR) 2008-09-18 WO disclosed
EP-1142883-A1 NOVEL HETEROCYCLIC COMPOUNDS AND DRUG COMPOSITIONS CONTAINING THE SAME Asahi Kasei Kabushiki Kaisha (JP) 2001-10-10 EP disclosed
US-6172099-B1 CARBAZOLE, DIBENZOFURAN, OR DIBENZOTHIOPHENE DERIVATIVES; DIETETICS, ANTIDIABETIC AGENTS; ANTILIPEMICS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-01-09 US disclosed
EP-0997458-A1 NOVEL TRICYCLIC COMPOUNDS HAVING SATURATED RINGS AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-05-03 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 (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-20100075994-A1 SUBSTITUTED DIHYDRO AND TETRAHYDRO OXAZOLOPYRIMIDINONES, PREPARATION AND USE THEREOF GRM2, GRM1, GRIN2C CYP1A2 411/4885CYP3A4 1201/4885CYP2C19 377/4885

“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.