SCHEMBL13619749

SCHEMBL13619749

CC(C)(C)NC(=O)c1cnn(-c2ccccc2)c1CF

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR4A3 Q92570 1/20 0.52
MAPT P10636 4/20 0.51
ALDH1A1 P00352 9/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPK1 P28482 6/20 0.48
LMNA P02545 2/20 0.48
POLB P06746 3/20 0.47
GAA P10253 1/20 0.47
MAPK14 Q16539 1/20 0.47
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
RIPK1 Q13546 1/20 0.45

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
SCHEMBL21366467 0.90 NR4A3 (0.55) NR4A3MAPTALDH1A1KDM4EMAPK1
SCHEMBL21366468 0.87 NR4A3 (0.52) NR4A3MAPTALDH1A1KDM4EMAPK1
SCHEMBL2854522 0.81 MAPK1 (0.64) MAPK1POLBHPGDSMN1; SMN2
SCHEMBL2854027 0.81 ALDH1A1 (0.72) MAPTALDH1A1KDM4ELMNAPOLB
SCHEMBL10202150 0.80 POLB (0.69) ALDH1A1KDM4EPOLBMAPK14HPGD
SCHEMBL13407216 0.78 MAPT (0.50) NR4A3MAPTALDH1A1KDM4EMAPK1
SCHEMBL21357511 0.76 ALDH1A1 (0.47) NR4A3MAPTALDH1A1MAPK1LMNA
SCHEMBL13101587 0.72 RIPK1 (0.51) MAPTALDH1A1KDM4ELMNAPOLB
SCHEMBL2856945 0.69 ALDH1A1 (0.81) MAPTALDH1A1MAPK1LMNAPOLB
SCHEMBL2854118 0.69 ALDH1A1 (0.56) MAPTALDH1A1KDM4ELMNAPOLB

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-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors Mirati Therapeutics, Inc. 2009-11-19 US disclosed
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY Mirati Therapeutics, Inc. 2009-10-22 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 (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-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors MAP3K19, MAP3K9, MAP4K2 NR4A3 3692/4885MAPT 1952/4885ALDH1A1 3152/4885
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET NR4A3 3176/4885MAPT 1806/4885ALDH1A1 3139/4885

“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.