SCHEMBL20249408

SCHEMBL20249408

CN(C)C(=O)CN1CCN(Cc2ccc(C(C)(C)C)nc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.47
PPARD Q03181 1/20 0.46
KMT2A Q03164 3/20 0.44
MEN1 O00255 1/20 0.44
ATM Q13315 1/20 0.44
KCNH2 Q12809 3/20 0.43
GPR119 Q8TDV5 3/20 0.43
MAP4K4 O95819 1/20 0.41
CCR9 P51686 3/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
AKT1 P31749 1/20 0.41
ALDH1A1 P00352 2/20 0.39
RET P07949 1/20 0.38
CSF1R P07333 1/20 0.37
FLT3 P36888 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
SCHEMBL20249406 0.85 PPARD (0.47) PPARDKMT2AMEN1ATMKCNH2
SCHEMBL18291679 0.83 DRD4 (0.50) DRD4PPARDKMT2AMEN1ATM
SCHEMBL20249403 0.82 ALDH1A1 (0.47) PPARDKMT2AMEN1ATMCCR9
SCHEMBL20249357 0.82 PPARD (0.53) PPARDKMT2AMEN1ATMKCNH2
SCHEMBL20255453 0.82 DRD4 (0.49) DRD4KMT2AMEN1ATMMAP4K4
SCHEMBL12606992 0.81 MEN1 (0.67) PPARDKMT2AMEN1ATMCCR9
SCHEMBL20249523 0.81 ATM (0.48) PPARDKMT2AMEN1ATMLMNA
SCHEMBL20249372 0.79 PPARD (0.49) PPARDKMT2AMEN1ATMCCR9
SCHEMBL20249414 0.79 ATM (0.51) PPARDKMT2AMEN1ATMLMNA
SCHEMBL10223577 0.78 LMNA (0.50) PPARDLMNAKDM4ENPC1RAB9A

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-20180161329-A1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TEIJIN PHARMA LIMITED (JP) 2018-06-14 US disclosed
US-20180161329-A1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TEIJIN PHARMA LIMITED (JP) 2018-06-14 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-20180161329-A1 PYRIDO[3,4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF CDK4, CDK6, CDK16 DRD4 1355/4885PPARD 260/4885KMT2A 670/4885

“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.