SCHEMBL13471763

SCHEMBL13471763

O=C(Nc1ccc(Oc2ccnc(C(=O)NCCS(=O)(=O)O)c2)cc1)Nc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 11/20 0.77
HDAC3 O15379 6/20 0.76
HDAC4 P56524 6/20 0.76
HDAC1 Q13547 6/20 0.76
HDAC7 Q8WUI4 6/20 0.76
HDAC2 Q92769 6/20 0.76
HDAC10 Q969S8 6/20 0.76
HDAC11 Q96DB2 6/20 0.76
HDAC8 Q9BY41 6/20 0.76
HDAC6 Q9UBN7 6/20 0.76
HDAC9 Q9UKV0 6/20 0.76
HDAC5 Q9UQL6 6/20 0.76
GSK3B P49841 2/20 0.76
KDR P35968 5/20 0.74
PDGFRB P09619 3/20 0.74
ARAF P10398 2/20 0.74
BRAF P15056 2/20 0.74
AURKB Q96GD4 2/20 0.72
MEN1 O00255 1/20 0.72
PLK4 O00444 1/20 0.72

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
SCHEMBL3707691 0.90 RAF1 (0.83) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL22001800 0.88 RAF1 (0.82) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL2480623 0.88 RAF1 (0.84) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL13471761 0.88 RAF1 (0.84) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL13471762 0.88 RAF1 (0.84) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL14479155 0.87 KDR (0.73) RAF1HDAC3HDAC4HDAC1HDAC7
Sorafenib SCHEMBL2045626 0.87 RAF1 (0.88) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL20386909 0.87 RAF1 (0.81) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL937568 0.87 RAF1 (1.00) RAF1HDAC3HDAC4HDAC1HDAC7
SCHEMBL21973628 0.87 RAF1 (0.82) RAF1HDAC3HDAC4HDAC1HDAC7

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-20120264789-A1 POLYMORPHS OF SORAFENIB ACID ADDITION SALTS RANBAXY LABORATORIES LIMITED (IN) 2012-10-18 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-20120264789-A1 POLYMORPHS OF SORAFENIB ACID ADDITION SALTS TP53, HCCS, SF3B5 RAF1 133/4885HDAC3 1229/4885HDAC4 1065/4885

“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.