SCHEMBL30899181

SCHEMBL30899181

C(=NNc1ncn(-c2ccncc2)n1)c1cccnc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.51
▸ CYP3A4 P08684 2/20 0.51
▸ MAPT P10636 8/20 0.51
▸ NPSR1 Q6W5P4 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ SMN1; SMN2 Q16637 7/20 0.49
▸ ALDH1A1 P00352 7/20 0.49
▸ GAA P10253 6/20 0.49
▸ LMNA P02545 4/20 0.49
▸ TDP1 Q9NUW8 3/20 0.48
▸ GFER P55789 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.47
▸ NPC1 O15118 5/20 0.47
▸ RAB9A P51151 5/20 0.47
▸ TSHR P16473 1/20 0.43
▸ POLB P06746 1/20 0.42

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
SCHEMBL30899182 0.79 MAPT (0.44) CYP1A2CYP3A4MAPTNPSR1MEN1
SCHEMBL30899178 0.72 MAPT (0.56) CYP1A2CYP3A4MAPTMEN1HTT
SCHEMBL30899179 0.72 MAPT (0.56) CYP1A2CYP3A4MAPTMEN1HTT
SCHEMBL11226669 0.68 ALDH1A1 (0.74) CYP1A2CYP3A4MAPTNPSR1MEN1
SCHEMBL11486327 0.68 ALDH1A1 (0.74) CYP1A2CYP3A4MAPTNPSR1MEN1
SCHEMBL30197946 0.68 CYP1A2 (0.68) CYP1A2CYP3A4MAPTNPSR1MEN1
SCHEMBL13380954 0.68 MAPT (1.00) CYP1A2CYP3A4MAPTNPSR1MEN1
SCHEMBL30899183 0.67 NPC1 (0.45) CYP1A2CYP3A4MAPTNPSR1MEN1
SCHEMBL22925149 0.66 L3MBTL1 (0.62) CYP1A2CYP3A4MAPTNPSR1MEN1
SCHEMBL11495662 0.65 MAPT (1.00) CYP1A2CYP3A4MAPTNPSR1MEN1

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-20240294536-A1 FUSED TRIAZOLO-PYRIMIDINE COMPOUNDS HAVING USEFUL PHARMACEUTICAL APPLICATION PIKSCI INC. (CA) 2024-09-05 — — 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-20240294536-A1 FUSED TRIAZOLO-PYRIMIDINE COMPOUNDS HAVING USEFUL PHARMACEUTICAL APPLICATION PIKFYVE, PIP4K2B, PIK3CA CYP1A2 4479/4885CYP3A4 2973/4885MAPT 3840/4885

“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.

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