SCHEMBL7092894

SCHEMBL7092894

Cc1cccc(N=CC=O)c1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.40
LMNA P02545 5/20 0.40
HTT P42858 3/20 0.40
GAA P10253 2/20 0.40
HPGD P15428 4/20 0.38
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
TRPA1 O75762 1/20 0.35
ATM Q13315 1/20 0.35
ALDH1A1 P00352 6/20 0.34
TSHR P16473 2/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
L3MBTL1 Q9Y468 4/20 0.34
POLB P06746 2/20 0.34
KDM4E B2RXH2 2/20 0.34
RECQL P46063 2/20 0.34
MPI P34949 1/20 0.34
RAB9A P51151 3/20 0.34
MAPK1 P28482 2/20 0.34
TDP1 Q9NUW8 2/20 0.34

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
SCHEMBL13590025 0.90 CYP3A4 (0.45) MAPTLMNAHTTGAAHPGD
SCHEMBL2976838 0.87 LMNA (0.42) MAPTLMNAHTTGAAHPGD
SCHEMBL7091919 0.83 CYP2C9 (0.52) MAPTLMNAHTTGAAHPGD
SCHEMBL20012708 0.80 LMNA (0.38) MAPTLMNAHTTGAAHPGD
SCHEMBL21649895 0.77 CYP2C9 (0.39) MAPTLMNAHTTGAAHPGD
SCHEMBL7091923 0.77 ALDH1A1 (0.38) MAPTLMNAHPGDCYP2C9TRPA1
SCHEMBL28051032 0.75 MAPT (0.38) MAPTLMNAHTTGAAHPGD
SCHEMBL13590030 0.74 MEN1 (0.47) MAPTLMNAGAAHPGDCYP2C9
SCHEMBL12025130 0.73 MEN1 (0.41) MAPTLMNAHPGDCYP2C9ALDH1A1
SCHEMBL11860615 0.72 CYP2C9 (0.48) MAPTLMNAHTTGAAHPGD

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-20070161619-A1 Pyrroloquinoline and piperidoquinoline derivatives, preparation thereof, compositions containing them and uses thereof ASTRAZENECA AB (SE) 2007-07-12 US disclosed
WO-2003084662-A2 COVALENTLY FIXED LIGAND SYSTEMS, NON-METALLOCENE SYSTEMS AND CATALYST SYSTEMS, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF FOR POLYMERIZING OLEFINS CELANESE VENTURES GMBH (DE) 2003-10-16 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-20070161619-A1 Pyrroloquinoline and piperidoquinoline derivatives, preparation thereof, compositions containing them and uses thereof OPRL1, OPRD1, OPRK1 MAPT 3850/4885LMNA 3122/4885HTT 2353/4885

“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.