SCHEMBL6510854

SCHEMBL6510854

CC#Cc1c[nH]c(=O)[nH]c1=O.OP(O)(O)=S

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPYD Q12882 4/20 0.49
GAA P10253 2/20 0.40
ATAD2 Q6PL18 1/20 0.40
MAPT P10636 3/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
CYP19A1 P11511 1/20 0.36
TSHR P16473 1/20 0.36
THPO P40225 1/20 0.36
MTOR P42345 1/20 0.36
HTT P42858 1/20 0.36
HBB P68871 1/20 0.36
PMP22 Q01453 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 2/20 0.33
CYP1A2 P05177 1/20 0.31
KDM4C Q9H3R0 1/20 0.30

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
SCHEMBL13296 0.89 DPYD (0.59) DPYDGAAATAD2MAPTALDH1A1
SCHEMBL6510851 0.89 DPYD (0.47) DPYDGAAATAD2MAPTALDH1A1
Thymine SCHEMBL14695416 0.81 ATAD2 (0.66) DPYDGAAATAD2MAPTALDH1A1
Pyrimidine SCHEMBL28139051 0.78 DPYD (0.46) DPYDGAAATAD2MAPTALDH1A1
Pyridine SCHEMBL28177470 0.78 DPYD (0.46) DPYDGAAATAD2MAPTALDH1A1
SCHEMBL4373860 0.75 DPYD (0.41) DPYDGAAATAD2MAPTALDH1A1
SCHEMBL309065 0.75 KDM3B (0.43) DPYD
Eniluracil SCHEMBL9539455 0.75 DPYD (0.65) DPYDGAAATAD2MAPTALDH1A1
SCHEMBL14177211 0.74 DPYD (0.59) DPYDGAAATAD2MAPTALDH1A1
SCHEMBL1908445 0.73 KMT2A (0.41) DPYDMAPTLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050059627-A1 CRF2 ligands in combination therapy HO SIEW PENG (US) 2005-03-17 US claimed
EP-1383460-A2 CRF 2? LIGANDS IN COMBINATION THERAPY Bristol-Myers Squibb Pharma Company (US) 2004-01-28 EP claimed
US-20020035083-A1 CRF2 ligands in combination therapy BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-03-21 US claimed
WO-2002005749-A2 CRF2 LIGANDS IN COMBINATION THERAPY BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-01-24 WO claimed
WO-2000042178-A2 ANTAGONIST BLOCKADE OF CRF2 RECEPTORS FOR THE TREATMENT OF PSY CHIATRIC DISORDERS AND THE USE OF CHIMERIC ANTISENSE OLIGONUCLEOTIDES IN IN VIVO CNS STUDIES OF GENE FUNCTION DUPONT PHARMACEUTICALS COMPANY (US) 2000-07-20 WO claimed
US-20050059627-A1 CRF2 ligands in combination therapy HO SIEW PENG (US) 2005-03-17 US disclosed
EP-1383460-A2 CRF 2? LIGANDS IN COMBINATION THERAPY Bristol-Myers Squibb Pharma Company (US) 2004-01-28 EP disclosed
US-20020035083-A1 CRF2 ligands in combination therapy BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-03-21 US disclosed
WO-2002005749-A2 CRF2 LIGANDS IN COMBINATION THERAPY BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-01-24 WO disclosed
WO-2000042178-A2 ANTAGONIST BLOCKADE OF CRF2 RECEPTORS FOR THE TREATMENT OF PSY CHIATRIC DISORDERS AND THE USE OF CHIMERIC ANTISENSE OLIGONUCLEOTIDES IN IN VIVO CNS STUDIES OF GENE FUNCTION DUPONT PHARMACEUTICALS COMPANY (US) 2000-07-20 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 (2 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-20020035083-A1 CRF2 ligands in combination therapy CRHR2, CRHR1, CRH DPYD 4635/4885GAA 2341/4885ATAD2 669/4885
US-20050059627-A1 CRF2 ligands in combination therapy CRHR2, CRHR1, CRH DPYD 4661/4885GAA 2260/4885ATAD2 673/4885

“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.