SCHEMBL3097883

SCHEMBL3097883

NC(=O)C1(C(=O)N(c2ccc(F)cc2)c2ccc(Oc3ccnc4[nH]ncc34)c(F)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 2/20 0.43
MET P08581 18/20 0.43
AXL P30530 6/20 0.42
KDR P35968 3/20 0.42
RET P07949 1/20 0.42
KIT P10721 1/20 0.42
PDGFRA P16234 1/20 0.42
MERTK Q12866 5/20 0.40

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
SCHEMBL4817745 0.87 MET (0.54) FLT3METKDRKIT
SCHEMBL19987721 0.83 MET (0.42) FLT3METAXLKDRRET
SCHEMBL3101845 0.83 MET (0.42) FLT3METAXLKDRRET
SCHEMBL29728994 0.82 MET (0.45) FLT3METAXLKDRRET
SCHEMBL22194083 0.82 AXL (0.45) FLT3METAXLKDRRET
SCHEMBL19987751 0.82 MET (0.45) FLT3METAXLKDRRET
SCHEMBL19987736 0.82 MET (0.49) FLT3METAXLKDRRET
SCHEMBL374396 0.82 MET (0.46) FLT3METAXLKDRRET
SCHEMBL3111149 0.82 MET (0.41) FLT3METAXLKDRRET
SCHEMBL3095588 0.81 MET (0.41) FLT3METAXLKDRRET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256356-A1 HETEROBICYCLIC PYRAZOLE COMPOUNDS AND METHODS OF USE ARRAY BIOPHARMA INC. (US) 2010-10-07 US disclosed
US-7723330-B2 Heterobicyclic pyrazole compounds and methods of use ARRAY BIOPHARMA INC. (US) 2010-05-25 US disclosed
EP-2001880-A2 HETEROBICYCLIC PYRAZOLE COMPOUNDS AND METHODS OF USE Array Biopharma, Inc. (US) 2008-12-17 EP disclosed
US-20070238726-A1 Heterobicyclic pyrazole compounds and methods of use GENENTECH, INC. 2007-10-11 US disclosed
WO-2007103308-A2 HETEROBICYCLIC PYRAZOLE COMPOUNDS AND METHODS OF USE ARRAY BIOPHARMA INC. (US) 2007-09-13 WO 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 (2 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-20100256356-A1 HETEROBICYCLIC PYRAZOLE COMPOUNDS AND METHODS OF USE ROR1, CYP11B1, CYP11B2 FLT3 87/4885MET 357/4885AXL 117/4885
US-20070238726-A1 Heterobicyclic pyrazole compounds and methods of use ROR1, CYP11B1, CYP11B2 FLT3 87/4885MET 357/4885AXL 117/4885

“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.