Pyrimidine

Pyrimidine

SCHEMBL9322876

O=S(=O)(O)O.c1cncnc1.c1cncnc1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Pyrimidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 2/20 0.42
CA5A P35218 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALOX12 P18054 1/20 0.32
CYP2A6 P11509 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
Pyrimidine SCHEMBL389598 1.00 NAPRT (0.42) NAPRTCA5ACA5BTSHRTDP1
Pyrimidine SCHEMBL21056190 1.00 NAPRT (0.42) NAPRTCA5ACA5BTSHRTDP1
Pyrimidine SCHEMBL29040951 1.00 NAPRT (0.42) NAPRTCA5ACA5BTSHRTDP1
Pyrimidine SCHEMBL27984552 0.97 NAPRT (0.41) NAPRTCA5ACA5BTSHRTDP1
Pyrimidine SCHEMBL22711662 0.97 NAPRT (0.41) NAPRTCA5ACA5BTSHRTDP1
Pyrimidine SCHEMBL15510413 0.89 NAPRT (0.37) NAPRTCA5ACA5B
Pyrimidine SCHEMBL2931357 0.88 NAPRT (0.39) NAPRTTSHRTDP1
Pyrimidine SCHEMBL11689582 0.88 CA1 (0.47) NAPRTCA5ACA5BTSHRTDP1
Pyrimidine SCHEMBL6623921 0.88 NAPRT (0.39) NAPRTTSHRTDP1
Pyrimidine SCHEMBL27442310 0.88 NAPRT (0.39) NAPRTTSHRTDP1

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-5292733-A Cephalosporin compounds LUCKY LIMITED (KR) 1994-03-08 US disclosed
EP-0508375-A2 Novel cephalosporin compounds and processes for preparation thereof LUCKY LTD. (KR) 1992-10-14 EP disclosed