SCHEMBL20913367

SCHEMBL20913367

CC(O)c1cc2cnc(Cl)nc2n1C1(CNC(=O)O)CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
P2RX7 Q99572 5/20 0.34
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
SLC6A9 P48067 4/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
HCN4 Q9Y3Q4 1/20 0.31
MC4R P32245 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL20913352 0.86 TP53 (0.35) TP53SLC6A9LMNANPC1HCN4
SCHEMBL16036398 0.85 TP53 (0.33) TP53HCN4MC4RALDH1A1
SCHEMBL20913345 0.84 TP53 (0.35) TP53P2RX7MEN1KMT2ASLC6A9
SCHEMBL20913362 0.82 TP53 (0.33) TP53P2RX7MEN1KMT2ASLC6A9
SCHEMBL25957164 0.80 STK17B (0.40) TP53
SCHEMBL20926948 0.78
SCHEMBL30926497 0.76 STK17B (0.37) TP53P2RX7HCN4
SCHEMBL16076736 0.76 STK17B (0.37) TP53P2RX7HCN4
SCHEMBL20959593 0.75 WNT1 (0.34) P2RX7
SCHEMBL20959598 0.75 WNT1 (0.34) P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200239486-A1 PYRIMIDINE-BASED COMPOUNDS FOR THE TREATMENT OF CANCER G1 THERAPEUTICS, INC. (US) 2020-07-30 US disclosed
US-10618905-B2 Pyrimidine-based compounds for the treatment of cancer G1 THERAPEUTICS, INC. (US) 2020-04-14 US disclosed
US-20190119294-A1 PYRIMIDINE-BASED COMPOUNDS FOR THE TREATMENT OF CANCER G1 THERAPEUTICS, INC. (US) 2019-04-25 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 (3 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-20190119294-A1 PYRIMIDINE-BASED COMPOUNDS FOR THE TREATMENT OF CANCER TYMS, TYMP, DPYD TP53 25/4885P2RX7 1297/4885MEN1 3076/4885
US-20200239486-A1 PYRIMIDINE-BASED COMPOUNDS FOR THE TREATMENT OF CANCER TYMS, TYMP, DPYD TP53 25/4885P2RX7 1297/4885MEN1 3076/4885
US-10618905-B2 Pyrimidine-based compounds for the treatment of cancer TYMS, TYMP, DPYD TP53 25/4885P2RX7 1297/4885MEN1 3076/4885

“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.