SCHEMBL12840491

SCHEMBL12840491

CCc1nc(-c2ccc(N)cc2)cnc1NC(=O)C(C)CC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.43
PIK3CA P42336 2/20 0.43
MAPK8 P45983 2/20 0.43
MAPK9 P45984 2/20 0.43
MAPK10 P53779 2/20 0.43
ADORA3 P0DMS8 1/20 0.42
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
FYN P06241 1/20 0.40
ATR Q13535 4/20 0.38
ATM Q13315 2/20 0.38
LDHA P00338 1/20 0.37
LDHB P07195 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
PARP1 P09874 1/20 0.36
ACVR1 Q04771 3/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL12839028 0.91 MAPK1 (0.43) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL12838913 0.89 ADORA3 (0.43) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL12839168 0.88 ADORA3 (0.42) ADORA3ADORA2AADORA1ATRKDM4E
SCHEMBL12840359 0.88 ADORA1 (0.55) MAPK1ADORA3ADORA2AADORA1ATR
SCHEMBL12839236 0.87 ADORA1 (0.45) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL12839050 0.87 MAPK1 (0.43) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL12838957 0.86 ADORA3 (0.46) MAPK1ADORA3ADORA2AADORA1FYN
SCHEMBL12839257 0.86 ADORA3 (0.44) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL12838991 0.85 MTOR (0.40) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL12840508 0.84 PIK3CA (0.46) MAPK1PIK3CAMAPK8MAPK9MAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110070656-A1 Fluorescent Proteins JNC CORPORATION (JP) 2011-03-24 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-20110070656-A1 Fluorescent Proteins CACYBP, CHLSN, LCP2 MAPK1 4830/4885PIK3CA 4787/4885MAPK8 4860/4885

“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.