SCHEMBL4547397

SCHEMBL4547397

CNC(=O)c1cc(Oc2ccc3nc(NCc4ccc(S(N)(=O)=O)cc4)sc3c2)ccn1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.58
CA1 P00915 3/20 0.58
CA2 P00918 3/20 0.58
CA7 P43166 3/20 0.58
RAF1 P04049 10/20 0.57
BRAF P15056 10/20 0.57
KCNH2 Q12809 1/20 0.57
CSF1R P07333 6/20 0.55
PDGFRB P09619 1/20 0.55
KIT P10721 1/20 0.55
PDGFRA P16234 1/20 0.55
FLT3 P36888 1/20 0.55

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
SCHEMBL14396807 0.90 RAF1 (0.59) RAF1BRAFKCNH2CSF1RPDGFRB
SCHEMBL2677610 0.89 RAF1 (0.61) RAF1BRAFKCNH2CSF1RPDGFRB
SCHEMBL2677525 0.88 BRAF (0.60) RAF1BRAFKCNH2CSF1RPDGFRB
SCHEMBL2677122 0.84 RAF1 (0.56) RAF1BRAFKCNH2CSF1RPDGFRB
SCHEMBL2677579 0.83 RAF1 (0.55) RAF1BRAFKCNH2CSF1RPDGFRB
SCHEMBL2678358 0.83 RAB9A (0.64) RAF1BRAFKCNH2CSF1RPDGFRB
SCHEMBL2676986 0.82 CSF1R (0.55) RAF1BRAFKCNH2CSF1RPDGFRB
SCHEMBL2676705 0.82 MAPK14 (0.63) RAF1BRAFKCNH2CSF1RPDGFRB
SCHEMBL2676237 0.81 BRAF (0.59) RAF1BRAFKCNH2CSF1RPDGFRB
SCHEMBL2676447 0.81 RAF1 (0.55) RAF1BRAFKCNH2CSF1RPDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8710048-B2 6-O-substituted benzoxazole and benzothiazole compounds and methods of inhibiting CSF-1R signaling NOVARTIS AG (CH) 2014-04-29 US disclosed
US-8710048-B2 6-O-substituted benzoxazole and benzothiazole compounds and methods of inhibiting CSF-1R signaling NOVARTIS AG (CH) 2014-04-29 US disclosed
US-20120225861-A1 6-O-Substituted Benzoxazole and Benzothiazole Compounds and Methods of Inhibiting CSF-1R Signaling NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 US disclosed
US-20120225861-A1 6-O-Substituted Benzoxazole and Benzothiazole Compounds and Methods of Inhibiting CSF-1R Signaling NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-09-06 US disclosed
US-8173689-B2 6-O-substituted benzoxazole and benzothiazole compounds and methods of inhibiting CSF-1R signaling NOVARTIS AG (CH) 2012-05-08 US disclosed
US-8173689-B2 6-O-substituted benzoxazole and benzothiazole compounds and methods of inhibiting CSF-1R signaling NOVARTIS AG (CH) 2012-05-08 US disclosed
US-20100280006-A1 6-O-substituted benzoxazole and benzothiazole compounds and methods of inhibiting CSF-1R signaling NOVARTIS AG (CH) 2010-11-04 US disclosed
US-20080045528-A1 6-O-SUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE COMPOUNDS AND METHODS OF INHIBITING CSF-1R SIGNALING NOVARTIS AG 2008-02-21 US disclosed
US-20080045528-A1 6-O-SUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE COMPOUNDS AND METHODS OF INHIBITING CSF-1R SIGNALING NOVARTIS AG 2008-02-21 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 (3 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-20120225861-A1 6-O-Substituted Benzoxazole and Benzothiazole Compounds and Methods of Inhibiting CSF-1R Signaling CSF1R, CSF3R, FLT3 CA12 2078/4885CA1 597/4885CA2 1308/4885
US-20100280006-A1 6-O-substituted benzoxazole and benzothiazole compounds and methods of inhibiting CSF-1R signaling CSF1R, CSF3R, FLT3 CA12 2078/4885CA1 597/4885CA2 1308/4885
US-20080045528-A1 6-O-SUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE COMPOUNDS AND METHODS OF INHIBITING CSF-1R SIGNALING CSF1R, CSF3R, FLT3 CA12 2078/4885CA1 597/4885CA2 1308/4885

“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.