SCHEMBL5548058

SCHEMBL5548058

CC1=C(C)C(c2ccccc2)C(C)C1=O.CC1=C(c2ccccc2)C(C)C(C)C1=O

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 2/20 0.30
ATM Q13315 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
HTR2B P41595 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
SCHEMBL5029403 0.87 SMN1; SMN2 (0.38) CRHBPCRHR2SMN1; SMN2LMNAATM
SCHEMBL5027310 0.85 CRHBP (0.37) CRHBPCRHR2SMN1; SMN2LMNAATM
SCHEMBL5032009 0.85 CRHBP (0.41) CRHBPCRHR2SMN1; SMN2LMNAATM
SCHEMBL5029369 0.69 PDE4B (0.36) CRHBPCRHR2SMN1; SMN2LMNAATM
SCHEMBL22012817 0.63 SMN1; SMN2 (0.38) SMN1; SMN2LMNAMEN1POLBKMT2A
SCHEMBL4942933 0.63 SMN1; SMN2 (0.38) SMN1; SMN2LMNAMEN1POLBKMT2A
SCHEMBL11547366 0.61 CYP1A2 (0.45) SMN1; SMN2LMNAATMNPSR1MEN1
SCHEMBL3201480 0.61
SCHEMBL12335675 0.61 EDNRA (0.38) SMN1; SMN2ATMNPSR1MEN1KMT2A
SCHEMBL28807029 0.60 LMNA (0.36) LMNATP53CYP1A2CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279605-B2 Synthesis of cyclopentenones FIRMENICH SA (CH) 2007-10-09 US disclosed
US-20070197833-A1 SYNTHESIS OF CYCLOPENTENONES FIRMENICH SA (CH) 2007-08-23 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-20070197833-A1 SYNTHESIS OF CYCLOPENTENONES COASY, CBR3, PPIC CRHBP 4186/4885CRHR2 3982/4885SMN1; SMN2 4362/4885

“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.