SCHEMBL1922536

SCHEMBL1922536

CCC(O)c1ccc(C)cc1OC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.48
POLB P06746 2/20 0.42
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
CYP3A4 P08684 2/20 0.40
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.40
ADRA2A P08913 1/20 0.40
ADRA1A P35348 1/20 0.40
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
PDE2A O00408 1/20 0.39
NFKB1 P19838 1/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
ALOX12 P18054 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP2C19 P33261 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
SCHEMBL9173075 0.82 ADRA2A (0.56) ACHEADRA2AADRA1AMEN1MAPK1
SCHEMBL14685815 0.81 ACHE (0.52) ACHEPOLBKDM4ETDP1CYP3A4
SCHEMBL14538804 0.81 ACHE (0.56) ACHEPOLBCYP3A4ALDH1A1ADRA1A
SCHEMBL14879247 0.81 GAA (0.53) ACHEKDM4ECYP3A4ALDH1A1TSHR
SCHEMBL31280738 0.81 PDE2A (0.45) KDM4ECYP3A4TSHRADRA2AADRA1A
SCHEMBL2632721 0.80 ACHE (0.50) ACHEPOLBKDM4ETDP1CYP3A4
SCHEMBL13345090 0.79 ACHE (0.54) ACHEPOLBKDM4ETDP1CYP3A4
SCHEMBL22910035 0.78 ADRA2A (0.42) POLBCYP3A4TSHRADRA2AADRA1A
SCHEMBL3929054 0.77 LMNA (0.48) ACHEPOLBALDH1A1TSHRADRA2A
SCHEMBL6055146 0.77 PDE2A (0.43) TDP1ADRA1AMAPTPDE2AMEN1

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-7994203-B2 Organic compounds NOVARTIS AG (CH) 2011-08-09 US disclosed
EP-2328902-A1 PYRAZOLO [5,1-B]OXAZOLE DERIVATIVES AS CRF1 ANTAGONISTS Novartis AG (CH) 2011-06-08 EP disclosed
WO-2010015628-A1 PYRAZOLO [5,1-B] OXAZOLE DERIVATIVES AS CRF1 ANTAGONISTS NOVARTIS AG (CH) 2010-02-11 WO disclosed
US-20100035874-A1 Organic compounds NOVARTIS AG (CH) 2010-02-11 US 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-20100035874-A1 Organic compounds CRH, CRHR1, CRHR2 ACHE 3743/4885POLB 3473/4885KDM4E 4367/4885

“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.