SCHEMBL25903530

SCHEMBL25903530

CCc1cnc2nc(CO)[nH]c(=O)c2n1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 8/20 0.47
HCAR2 Q8TDS4 1/20 0.41
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TNKS2 Q9H2K2 1/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ADORA3 P0DMS8 2/20 0.32
TYMS P04818 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
AKR1B1 P15121 1/20 0.31
TSHR P16473 1/20 0.31
PTGS2 P35354 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL24629160 0.82 ALDH1A1 (0.52) NOS1HCAR2ALDH1A1HPGDHSD17B10
SCHEMBL12948270 0.79 NOS1 (0.72) NOS1ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL25899166 0.78 HSD17B10 (0.49) NOS1HCAR2ALDH1A1HPGDHSD17B10
SCHEMBL16333642 0.73 NOS1 (0.40) NOS1ALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL1981720 0.73 NOS1 (0.68) NOS1ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL16984409 0.72 XDH (0.49) NOS1ALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL9196608 0.71 AKR1B1 (0.40) HCAR2KDM4EMEN1KMT2AGAA
SCHEMBL3817859 0.68 TNKS2 (0.44) NOS1HCAR2ALDH1A1HPGDSMN1; SMN2
SCHEMBL9562969 0.68 KDM4C (0.43) NOS1ALDH1A1HPGDHSD17B10SMN1; SMN2
SCHEMBL1520051 0.68 NOS1 (0.68) NOS1ALDH1A1HPGDHSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230226214-A1 BIFUNCTIONAL BRIDGING COMPOSITIONS FOR VIRAL TRANSDUCTION LYCIA THERAPEUTICS, INC. 2023-07-20 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-20230226214-A1 BIFUNCTIONAL BRIDGING COMPOSITIONS FOR VIRAL TRANSDUCTION HAVCR2, FCGR3B, FCGR2A NOS1 4318/4885HCAR2 2754/4885ALDH1A1 4520/4885

“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.