SCHEMBL7711368

SCHEMBL7711368

CC(C)(C)OC(=O)N1CCC(c2nc(C3CCOCC3)oc2Br)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
USP2 O75604 1/20 0.46
THRB P10828 2/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 3/20 0.41
KDM4E B2RXH2 1/20 0.41
GPR119 Q8TDV5 4/20 0.41
LMNA P02545 1/20 0.40
FAAH O00519 2/20 0.40
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 1/20 0.39
JAK3 P52333 1/20 0.39
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39

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
SCHEMBL7715739 0.76 RECQL (0.48) RECQLSMN1; SMN2USP2THRBGAA
SCHEMBL14617550 0.75 FAAH (0.68) SMN1; SMN2FAAH
SCHEMBL38653489 0.74 RECQL (0.48) RECQLSMN1; SMN2USP2THRBMAPT
SCHEMBL16399632 0.74 SMN1; SMN2 (0.61) RECQLSMN1; SMN2USP2THRBGAA
SCHEMBL7718857 0.73 GPR119 (0.52) SMN1; SMN2THRBGAAMAPTGPR119
SCHEMBL23210070 0.72 GPR119 (0.57) RECQLSMN1; SMN2USP2THRBGAA
SCHEMBL29691314 0.72 GPR119 (0.57) RECQLSMN1; SMN2USP2THRBGAA
SCHEMBL20116051 0.72 RECQL (0.51) RECQLSMN1; SMN2USP2THRBGAA
SCHEMBL23411131 0.72 SMN1; SMN2 (0.49) SMN1; SMN2USP2THRBGAAMAPT
SCHEMBL14157385 0.72 SMN1; SMN2 (0.49) SMN1; SMN2THRBGAAMAPTKDM4E

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-2555772-B1 OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH MERCK SHARP & DOHME (US) 2017-01-11 EP disclosed
US-9193697-B2 Oxazole derivatives useful as modulators of FAAH MERCK SHARP & DOHME CORP. (US) 2015-11-24 US disclosed
US-9193697-B2 Oxazole derivatives useful as modulators of FAAH MERCK SHARP & DOHME CORP. (US) 2015-11-24 US disclosed
US-20130018048-A1 OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH MERCK SHARP & DOHME CORP. (US) 2013-01-17 US disclosed
US-20130018048-A1 OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH MERCK SHARP & DOHME CORP. (US) 2013-01-17 US disclosed
WO-2011126960-A1 OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH MERCK SHARP & DOHME CORP. (US) 2011-10-13 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-20130018048-A1 OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH FAAH, FAAH2, ALOX5 RECQL 3592/4885SMN1; SMN2 304/4885USP2 1620/4885

“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.