SCHEMBL20203486

SCHEMBL20203486

CS(=O)(=O)c1ncc2cc(COC(=O)c3ccccc3)nc(N3CCCCC3)c2n1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 3/20 0.39
PKM P14618 1/20 0.38
L3MBTL1 Q9Y468 4/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPK1 P28482 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 1/20 0.36
ALOX5 P09917 1/20 0.36
P2RY12 Q9H244 1/20 0.35

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
SCHEMBL20203438 0.86 MEN1 (0.48) TP53LMNAMAPTL3MBTL1ALDH1A1
SCHEMBL21403245 0.81 KMT2A (0.37) TP53LMNAMAPTL3MBTL1ALDH1A1
SCHEMBL20203485 0.81 KMT2A (0.37) TP53LMNAMAPTL3MBTL1ALDH1A1
SCHEMBL21403165 0.77 PDE4B (0.42) TP53MAPTL3MBTL1ALDH1A1KDM4E
SCHEMBL20203462 0.77 MEN1 (0.46) TP53LMNAPKML3MBTL1ALDH1A1
SCHEMBL20203534 0.77 FFAR2 (0.36) MAPTTDP1MAPK1SMN1; SMN2RAB9A
SCHEMBL23733417 0.77 OPRK1 (0.37) TP53MAPTL3MBTL1
SCHEMBL20203535 0.77 MAPT (0.38) TP53MAPTL3MBTL1ALDH1A1KDM4E
SCHEMBL23733416 0.77 POLB (0.43) TP53LMNAMAPTL3MBTL1ALDH1A1
SCHEMBL20203487 0.75 LMNA (0.38) TP53LMNAPKML3MBTL1ALDH1A1

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-11084814-B2 Pyrido[3, 4-d]pyrimidine derivative and pharmaceutically acceptable salt thereof TEIJIN PHARMA LIMITED (JP) 2021-08-10 US disclosed
WO-2018097297-A1 PYRIDO[3, 4-D]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF 帝人ファーマ株式会社 2018-05-31 WO 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-11084814-B2 Pyrido[3, 4-d]pyrimidine derivative and pharmaceutically acceptable salt thereof CDK4, CDK6, CDK16 TP53 176/4885LMNA 3711/4885MAPT 2593/4885

“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.