SCHEMBL12376633

SCHEMBL12376633

CC(C)(C)NC(=O)C1CCCN(c2ccc(F)cc2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.46
LMNA P02545 1/20 0.41
FPR2 P25090 4/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RECQL P46063 1/20 0.41
TP53 P04637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
AXL P30530 2/20 0.40
MERTK Q12866 1/20 0.40
FPR1 P21462 2/20 0.40
LIPE Q05469 2/20 0.39
ACKR3 P25106 4/20 0.39

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
SCHEMBL2605828 0.92 MET (0.45) METLMNAFPR2MAPTMEN1
SCHEMBL12848454 0.86 MET (0.50) METLMNAFPR2MAPTMEN1
SCHEMBL12561301 0.84 MET (0.48) METLMNAFPR2MAPTMEN1
SCHEMBL3921711 0.83 MAPT (0.49) METLMNAFPR2MAPTMEN1
SCHEMBL12561588 0.82 MET (0.46) METLMNAFPR2MAPTMEN1
SCHEMBL13368452 0.82 LMNA (0.48) METLMNAFPR2MAPTMEN1
SCHEMBL14411965 0.81 MET (0.45) METLMNAFPR2MAPTMEN1
SCHEMBL12411809 0.81 MET (0.45) METLMNAFPR2MAPTMEN1
SCHEMBL12561396 0.80 MET (0.46) METLMNAFPR2MAPTMEN1
SCHEMBL10202744 0.79 USP30 (0.54) METLMNAFPR2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003662-B2 Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA, INC. (US) 2011-08-23 US disclosed
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
US-20070238726-A1 Heterobicyclic pyrazole compounds and methods of use GENENTECH, INC. 2007-10-11 US disclosed
US-20070197537-A1 Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA, INC. 2007-08-23 US disclosed
US-20070197537-A1 Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA, INC. 2007-08-23 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-20070197537-A1 Heterobicyclic thiophene compounds and methods of use ERBB2, LCK, SRC MET 142/4885LMNA 4174/4885FPR2 1036/4885
US-20100256356-A1 HETEROBICYCLIC PYRAZOLE COMPOUNDS AND METHODS OF USE ROR1, CYP11B1, CYP11B2 MET 357/4885LMNA 1962/4885FPR2 930/4885
US-20070238726-A1 Heterobicyclic pyrazole compounds and methods of use ROR1, CYP11B1, CYP11B2 MET 357/4885LMNA 1962/4885FPR2 930/4885

“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.