SCHEMBL3148762

SCHEMBL3148762

Oc1ccc(C2[CH]CCCCCC2)cc1.[CH2].[CH2]

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 15/20 0.38
DEGS1 O15121 1/20 0.37
KMT2A Q03164 1/20 0.37
ESR1 P03372 7/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2D6 P10635 1/20 0.35
EPHX1 P07099 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL6831259 0.90 ESR2 (0.42) ESR2ESR1CYP3A4CYP2C9CYP2D6
SCHEMBL11484818 0.78 SLC18A3 (0.40) KMT2A
SCHEMBL21755529 0.77 ESR2 (0.38) ESR2DEGS1ESR1CYP3A4CYP2C9
SCHEMBL777679 0.76 ATM (0.39) KMT2AEPHX1NPC1RAB9A
SCHEMBL29097668 0.76 SLC18A3 (0.38) KMT2ACYP3A4NPC1RAB9A
SCHEMBL777693 0.75 ALDH1A1 (0.41) KMT2ACYP2C9CYP2D6
SCHEMBL2160450 0.75 ALDH1A1 (0.41) KMT2ACYP2C9CYP2D6
SCHEMBL2157992 0.75 ALDH1A1 (0.41) KMT2ACYP2C9CYP2D6
SCHEMBL9067822 0.74
SCHEMBL17090740 0.73 KMT2A (0.33) ESR2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 ESR2 491/4885DEGS1 1031/4885KMT2A 963/4885

“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.