SCHEMBL1662884

SCHEMBL1662884

CCC(=O)c1c(OC)cc(COC)cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 1/20 0.46
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
CYP3A4 P08684 3/20 0.44
PTGS1 P23219 1/20 0.44
DRD3 P35462 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
HPGD P15428 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MAPT P10636 2/20 0.42
GAA P10253 1/20 0.42
CA9 Q16790 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
USP2 O75604 1/20 0.39
MAPK1 P28482 1/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.38

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
SCHEMBL1612678 0.84 HPGDS (0.44) KMT2AMEN1CYP3A4SMN1; SMN2HPGD
SCHEMBL1613083 0.81 CYP3A4 (0.53) KMT2AMEN1CYP3A4SMN1; SMN2HPGD
SCHEMBL20627981 0.81 CA12 (0.52) KMT2AMEN1CYP3A4SMN1; SMN2HPGD
SCHEMBL8546247 0.79 CYP3A4 (0.55) HMGCRKMT2ACYP3A4SMN1; SMN2CA9
SCHEMBL12712826 0.76 HPGDS (0.40) KMT2AMEN1CYP3A4SMN1; SMN2HPGD
SCHEMBL9752929 0.76 HMGCR (0.50) HMGCRKMT2AMEN1CYP3A4PTGS1
SCHEMBL1661748 0.75 ALOX15 (0.38) KMT2AMEN1CYP3A4SMN1; SMN2HPGD
SCHEMBL30506419 0.74 CYP3A4 (0.67) HMGCRKMT2AMEN1CYP3A4PTGS1
SCHEMBL2874467 0.74 CYP3A4 (0.67) HMGCRKMT2AMEN1CYP3A4PTGS1
SCHEMBL8239580 0.73 CA9 (0.61) HMGCRSMN1; SMN2CA9POLB

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
CN-102007133-B 3-phenylpyrazolo [5,1-b ] thiazole compounds EISAI R&D MAN CO LTD 2013-06-12 CN disclosed
EP-2487177-A1 PYRAZOLOXAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2012-08-15 EP disclosed
EP-2487177-A1 PYRAZOLOXAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2012-08-15 EP disclosed
US-20110086898-A1 PYRAZOLOOXAZOLE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-04-14 US disclosed
US-20110086898-A1 PYRAZOLOOXAZOLE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-04-14 US disclosed
US-20110086898-A1 PYRAZOLOOXAZOLE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-04-14 US disclosed
WO-2011043387-A1 PYRAZOLOXAZOLE COMPOUND エーザイ・アール・アンド・ディー・マネジメント株式会社 (JP) 2011-04-14 WO disclosed
CN-102007133-A 3-phenylpyrazolo [5,1-b ] thiazole compounds EISAI R&D MAN CO LTD 2011-04-06 CN 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-20110086898-A1 PYRAZOLOOXAZOLE COMPOUND CRHR1, MC2R, CRHR2 HMGCR 4359/4885KMT2A 4639/4885MEN1 2587/4885

“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.