SCHEMBL2967295

SCHEMBL2967295

COC(=O)c1ccc2c(c1)c(-c1cccc(C(=O)O)c1)nn2C1CCCCO1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 5/20 0.41
PDE7A Q13946 3/20 0.41
DGAT2 Q96PD7 1/20 0.41
PPM1D O15297 2/20 0.41
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
PDE4B Q07343 2/20 0.38
PDE4A P27815 1/20 0.38
PDE4C Q08493 1/20 0.38
CPT2 P23786 1/20 0.38
CPT1A P50416 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
MERTK Q12866 2/20 0.37
AXL P30530 1/20 0.37
TYRO3 Q06418 1/20 0.37

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
SCHEMBL5377997 0.93 MAP2K4 (0.41) PDE4DPDE7ADGAT2CPT2CPT1A
SCHEMBL5378434 0.88 CREBBP (0.41) PDE4DPDE7ADGAT2CPT2CPT1A
SCHEMBL5373140 0.82 CPT2 (0.35) PDE4DPDE7ADGAT2RXRARXRB
SCHEMBL5823945 0.82 CPT2 (0.35) PDE4DPDE7ADGAT2RXRARXRB
SCHEMBL5378433 0.82 CREBBP (0.40) PDE4DPDE7ADGAT2RXRARXRB
SCHEMBL4079169 0.81 KDM4E (0.44) RXRARXRBRXRGALDH1A1HPGD
SCHEMBL30159592 0.81 DGAT2 (0.40) PDE7ADGAT2RXRARXRBRXRG
SCHEMBL10324149 0.81 DGAT2 (0.40) PDE7ADGAT2RXRARXRBRXRG
SCHEMBL20465115 0.81 FGFR4 (0.41) DGAT2CHRM2CHRM4CHRM5CHRM1
SCHEMBL30971974 0.81 FGFR4 (0.41) DGAT2CHRM2CHRM4CHRM5CHRM1

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-7772246-B2 Pyrazole compounds as RAF inhibitors PFIZER INC. (US) 2010-08-10 US disclosed
US-20090221608-A1 PYRAZOLE COMPOUNDS PFIZER INC. 2009-09-03 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-20090221608-A1 PYRAZOLE COMPOUNDS BRAF, RAF1, NRAS PDE4D 1254/4885PDE7A 1488/4885DGAT2 3238/4885

“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.