SCHEMBL7073980

SCHEMBL7073980

N#CC(=Cc1ccco1)c1n[nH]c(N)c1C#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.44
▸ MEN1 O00255 8/20 0.44
▸ KMT2A Q03164 8/20 0.44
▸ HPGD P15428 6/20 0.44
▸ RECQL P46063 4/20 0.44
▸ LMNA P02545 3/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ NFKB2 Q00653 1/20 0.44
▸ RELA Q04206 1/20 0.44
▸ POLB P06746 4/20 0.43
▸ TDP1 Q9NUW8 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ GAA P10253 2/20 0.43
▸ THRB P10828 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ ALDH1A1 P00352 7/20 0.38
▸ TSHR P16473 2/20 0.38
▸ ALOX15 P16050 2/20 0.38

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
SCHEMBL7073978 1.00 MAPT (0.44) MAPTMEN1KMT2AHPGDRECQL
SCHEMBL7071008 0.79 CYP2A6 (0.40) MAPTMEN1KMT2AHPGDRECQL
SCHEMBL7071012 0.79 CYP2A6 (0.40) MAPTMEN1KMT2AHPGDRECQL
SCHEMBL7066942 0.78 MAPT (0.39) MAPTMEN1KMT2AHPGDLMNA
SCHEMBL7066943 0.78 MAPT (0.39) MAPTMEN1KMT2AHPGDLMNA
SCHEMBL7067474 0.75 NPC1 (0.48) MAPTMEN1KMT2AHPGDRECQL
SCHEMBL7067471 0.75 NPC1 (0.48) MAPTMEN1KMT2AHPGDRECQL
SCHEMBL7074094 0.73 PIP4K2A (0.43) MAPTMEN1KMT2AHPGDLMNA
SCHEMBL15756546 0.73 RAB9A (0.57) MAPTMEN1KMT2AHPGDRECQL
SCHEMBL5607176 0.69 KMT2A (0.56) MAPTMEN1KMT2AHPGDRECQL

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
US-20030134862-A1 Compounds BIOVITRUM AB (SE) 2003-07-17 — — US disclosed
WO-2003053976-A1 PIPAZOLO [1,5-a] PYRIMIDINE DERIVATIVES AS MODULATORS OF PPAR BIOVITRUM AB (SE) 2003-07-03 — — 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 (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-20030134862-A1 Compounds PPARG, PPARA, PPARD MAPT 4576/4885MEN1 4827/4885KMT2A 3265/4885

“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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