SCHEMBL2497536

SCHEMBL2497536

CN(C)CCCCNc1ccc(NC(=O)Cc2ccc(-n3cnc4cccnc43)cc2)cc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TP53 P04637 4/20 0.41
MAPT P10636 4/20 0.41
RORC P51449 1/20 0.38
ATM Q13315 1/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
HTR1A P08908 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
HTR1D P28221 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37
GABRA4 P48169 1/20 0.37
GABRE P78334 1/20 0.37

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
SCHEMBL1414407 0.89 KDR (0.47) ATM
SCHEMBL1408415 0.87 MAPT (0.43) MEN1KMT2ATP53MAPTRORC
SCHEMBL2493629 0.86 ROCK2 (0.39) ATMADRA1DADRA1AADRA1BHTR2B
SCHEMBL1408584 0.84 MAPT (0.46) MEN1KMT2ATP53MAPTRORC
SCHEMBL1407936 0.81 MAPT (0.52) MEN1KMT2ATP53MAPTRORC
SCHEMBL1408513 0.81 MAPT (0.45) MEN1KMT2ATP53MAPTRORC
SCHEMBL1407961 0.81 MAPT (0.48) MEN1KMT2ATP53MAPTRORC
SCHEMBL1408559 0.78 KCNJ5 (0.41) TP53MAPTRORCGABRPGABRD
SCHEMBL1408435 0.78 MCHR1 (0.44) MEN1KMT2ATP53MAPTRORC
SCHEMBL2205874 0.78 NR2E1 (0.44) MEN1KMT2ATP53MAPTGABRP

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-8030311-B2 Phenylacetamides suitable as protein kinase inhibitors NOVARTIS AG (CH) 2011-10-04 US disclosed
US-20080319005-A1 Phenylacetamides Suitable as Protein Kinase Inhibitors NOVARTIS AG (CH) 2008-12-25 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-20080319005-A1 Phenylacetamides Suitable as Protein Kinase Inhibitors MAP3K20, MAP3K10, MAP3K9 MEN1 3250/4885KMT2A 584/4885TP53 188/4885

“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.