SCHEMBL17705129

SCHEMBL17705129

Cn1c2ccncc2c2ccc(-c3ccc([N+](=O)[O-])nc3)cc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.41
POLB P06746 2/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
MAPT P10636 6/20 0.36
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
TOP2A P11388 1/20 0.33
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
METAP2 P50579 1/20 0.32
ROCK2 O75116 1/20 0.32

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
SCHEMBL16268477 0.83 HIPK2 (0.33) POLBMAPTMETAP2
SCHEMBL16268476 0.83 HIPK2 (0.33) POLBMAPTMETAP2
SCHEMBL20128566 0.81 NPC1 (0.43) RAB9APOLBNPC1GAARXFP1
SCHEMBL14134198 0.80 MAPT (0.48) RAB9APOLBNPC1GAARXFP1
SCHEMBL22906702 0.80 NPC1 (0.43) RAB9APOLBNPC1GAARXFP1
SCHEMBL29547590 0.80 MAPT (0.48) RAB9APOLBNPC1GAARXFP1
SCHEMBL16268180 0.79 GABRG2 (0.38) MAPT
SCHEMBL27097256 0.79 NPC1 (0.41) RAB9APOLBNPC1GAARXFP1
SCHEMBL20128557 0.77 CYP11B2 (0.47) METAP2
SCHEMBL13465254 0.76 MAPT (0.56) MAPT

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-20160115162-A1 Radiosynthesis of Tau Radiopharmaceuticals THE GENERAL HOSPITAL CORPORATION 2016-04-28 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-20160115162-A1 Radiosynthesis of Tau Radiopharmaceuticals HTR7, MAPT, TSN RAB9A 1795/4885POLB 104/4885NPC1 2012/4885

“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.