SCHEMBL18711844

SCHEMBL18711844

Cc1nn2cc(F)cc2c(=O)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SPR P35270 5/20 0.41
PARP1 P09874 5/20 0.38
TNKS O95271 2/20 0.38
TNKS2 Q9H2K2 2/20 0.38
TYMS P04818 2/20 0.35
ADORA3 P0DMS8 5/20 0.34
CYP1A2 P05177 1/20 0.33
CDK4 P11802 1/20 0.32
CCND1 P24385 1/20 0.32
HPGD P15428 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
SCHEMBL25080175 0.82 PARP1 (0.40) PARP1TNKSTNKS2ADORA3CYP1A2
SCHEMBL18703618 0.79 SPR (0.38) SPRPARP1TNKSTNKS2
SCHEMBL18711958 0.79 SPR (0.39) SPRPARP1TNKSTNKS2ADORA3
SCHEMBL18701526 0.79 TNKS (0.39) SPRPARP1TNKSTNKS2
SCHEMBL18703619 0.79 SPR (0.37) SPRPARP1TNKSTNKS2HPGD
SCHEMBL18703620 0.78 SPR (0.37) SPRPARP1TNKSTNKS2
SCHEMBL16707618 0.71 TNKS (0.51) SPRPARP1TNKSTNKS2
SCHEMBL17241119 0.68 SPR (0.37) SPRPARP1TNKSHPGD
SCHEMBL15527637 0.68 TNKS (0.47) SPRPARP1TNKSTNKS2HPGD
SCHEMBL12102064 0.68 TNKS2 (0.36) SPRPARP1TNKSTNKS2ADORA3

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
EP-3356345-B1 HETEROARYL DERIVATIVES AS SEPIAPTERIN REDUCTASE INHIBITORS MAX PLANCK GESELLSCHAFT (DE) 2023-11-08 EP disclosed
US-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-04-06 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-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS SPR, QDPR, SRR SPR 1/4885PARP1 2611/4885TNKS 3452/4885

“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.