SCHEMBL4547675

SCHEMBL4547675

Cc1c(F)cc(CC(/C=C/c2ccccc2O)CCc2ccc(C#N)cc2)cc1F

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31

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
SCHEMBL2675146 0.85 CYP19A1 (0.31) CYP19A1
SCHEMBL2675148 0.85 CYP19A1 (0.31) CYP19A1
SCHEMBL4603613 0.85 CYP19A1 (0.31) CYP19A1
SCHEMBL13629738 0.82 MAPT (0.33) MEN1ALDH1A1KMT2A
SCHEMBL4547671 0.82 CCR6 (0.39) MEN1ALDH1A1KMT2A
SCHEMBL4547673 0.81 MMP12 (0.37) CYP19A1MMP12MMP13
SCHEMBL4515111 0.80 TAS2R14 (0.40) MEN1ALDH1A1KMT2AMMP12MMP13
SCHEMBL4515115 0.80 TAS2R14 (0.40) MEN1ALDH1A1KMT2AMMP12MMP13
SCHEMBL2292822 0.78 PRSS1 (0.40) MEN1ALDH1A1KMT2AMMP12MMP13
SCHEMBL2295655 0.78 PRSS1 (0.40) MEN1ALDH1A1KMT2AMMP12MMP13

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-8173704-B2 Difluorophenol derivatives and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-05-08 US disclosed
US-20090291993-A1 Difluorophenol Derivatives and Their Use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2009-11-26 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-20090291993-A1 Difluorophenol Derivatives and Their Use TPMT, FABP3, DPP4 CYP19A1 784/4885MEN1 3679/4885ALDH1A1 168/4885

“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.