SCHEMBL6425948

SCHEMBL6425948

Cc1c(C(C(=O)O)C(C)C)c2cc(O)c(F)cc2n1C(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRC P12931 5/20 0.45
PRKACA P17612 4/20 0.45
PRKACG P22612 4/20 0.45
PRKACB P22694 4/20 0.45
AKR1C3 P42330 4/20 0.42
AKR1C2 P52895 3/20 0.42
BCL2L1 Q07817 1/20 0.40
BCL2 P10415 2/20 0.35
MCL1 Q07820 2/20 0.35
MDM2 Q00987 1/20 0.35
PTGS2 P35354 2/20 0.34
PPARG P37231 1/20 0.34
LDHA P00338 1/20 0.33
LDHB P07195 1/20 0.33

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
SCHEMBL6425439 0.91 SRC (0.47) SRCPRKACAPRKACGPRKACBAKR1C3
SCHEMBL6422783 0.91 SRC (0.43) SRCPRKACAPRKACGPRKACBAKR1C3
SCHEMBL6426036 0.91 SRC (0.43) SRCPRKACAPRKACGPRKACBAKR1C3
SCHEMBL6423693 0.91 SRC (0.43) SRCPRKACAPRKACGPRKACBAKR1C3
SCHEMBL6426033 0.91 SRC (0.43) SRCPRKACAPRKACGPRKACBAKR1C3
SCHEMBL6422788 0.91 SRC (0.43) SRCPRKACAPRKACGPRKACBAKR1C3
SCHEMBL6425754 0.90 SRC (0.38) SRCAKR1C3AKR1C2BCL2MCL1
SCHEMBL6424376 0.90 AKR1C3 (0.40) SRCPRKACAPRKACGPRKACBAKR1C3
SCHEMBL6424047 0.89 SRC (0.44) SRCPRKACAPRKACGPRKACBAKR1C3
SCHEMBL6425642 0.88 SRC (0.45) SRCPRKACAPRKACGPRKACBAKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050234244-A1 Synthesis of COX-2 and FAAH inhibitors IRONWOOD PHARMACEUTICALS, INC. 2005-10-20 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-20050234244-A1 Synthesis of COX-2 and FAAH inhibitors FAAH2, FAAH, PTGES2 SRC 3467/4885PRKACA 1966/4885PRKACG 1457/4885

“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.