SCHEMBL3134427

SCHEMBL3134427

CN1C(C)(C)C=C(c2ccc(O)cc2)CC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ QDPR P09417 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.35
▸ ESR1 P03372 4/20 0.33
▸ TGFBR1 P36897 2/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ AR P10275 1/20 0.30
▸ HSD17B1 P14061 1/20 0.30

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
SCHEMBL4554358 0.91 SMN1; SMN2 (0.43) SMN1; SMN2QDPRHSD17B10ESR1TGFBR1
SCHEMBL5392280 0.71 — —
SCHEMBL14008437 0.68 GAA (0.36) SMN1; SMN2KDM4EALDH1A1
SCHEMBL20392266 0.67 SMN1; SMN2 (0.51) SMN1; SMN2QDPRHSD17B10ESR1TGFBR1
SCHEMBL7033604 0.66 SMN1; SMN2 (0.50) SMN1; SMN2QDPRHSD17B10ESR1ESR2
Hydrochloric Acid SCHEMBL8476099 0.66 SMN1; SMN2 (0.97) SMN1; SMN2QDPRHSD17B10ESR1ESR2
SCHEMBL24839989 0.62 SMN1; SMN2 (0.46) SMN1; SMN2QDPRHSD17B10ESR1ESR2
SCHEMBL5077540 0.62 SMN1; SMN2 (0.46) SMN1; SMN2QDPRHSD17B10ESR1ESR2
SCHEMBL10828923 0.61 QDPR (0.56) SMN1; SMN2QDPRESR1ESR2AR
SCHEMBL2720984 0.58 ESR1 (0.56) SMN1; SMN2QDPRHSD17B10ESR1ESR2

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
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
CN-101675060-A Substituted dihydro and tetrahydro oxazolopyrimidinones, their preparation and use SANOFI AVENTIS 2010-03-17 — — CN 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 SMN1; SMN2 728/4885QDPR 69/4885HSD17B10 2991/4885

“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.

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