SCHEMBL20249221

SCHEMBL20249221

CCNC(=O)NCc1ccc(C(C)(C)C)nc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
NAMPT P43490 9/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
CYP2C9 P11712 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
POLB P06746 1/20 0.39
PPIB P23284 1/20 0.39
PPIA P62937 1/20 0.39
PPID Q08752 1/20 0.39
PPIG Q13427 1/20 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
SCHEMBL20249197 0.83 KMT2A (0.47) SMN1; SMN2L3MBTL1KMT2ALMNAHTT
SCHEMBL20249179 0.82 RECQL (0.50) SMN1; SMN2NAMPTL3MBTL1TRPV1CYP2C9
SCHEMBL18291355 0.79 NAMPT (0.53) SMN1; SMN2NAMPTMEN1KMT2APOLB
SCHEMBL27799938 0.79 NAMPT (0.53) SMN1; SMN2NAMPTL3MBTL1CYP2C9MEN1
SCHEMBL20037860 0.79 MEN1 (0.42) SMN1; SMN2NAMPTMEN1KMT2APOLB
SCHEMBL3216761 0.75 KMT2A (0.62) L3MBTL1TRPV1MEN1KMT2AHTT
SCHEMBL15498266 0.74 CA2 (0.38) SMN1; SMN2L3MBTL1MEN1KMT2ALMNA
SCHEMBL15215455 0.74 CA12 (0.46) SMN1; SMN2L3MBTL1LMNAHTT
SCHEMBL3196417 0.72 P2RX7 (0.49) SMN1; SMN2TRPV1MEN1KMT2A
SCHEMBL16544500 0.72 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1MEN1KMT2ALMNA

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 SMN1; SMN2 1690/4885NAMPT 256/4885L3MBTL1 3990/4885

“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.