SCHEMBL6705337

SCHEMBL6705337

[CH2]NCc1cc2ccccc2cn1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CYP1A2 P05177 2/20 0.44
CYP2A6 P11509 1/20 0.44
PDPK1 O15530 1/20 0.44
PDE10A Q9Y233 3/20 0.38
KDM4C Q9H3R0 1/20 0.38
NPC1 O15118 2/20 0.37
PLAU P00749 1/20 0.37
RAB9A P51151 1/20 0.35
CHEK1 O14757 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
IDH1 O75874 1/20 0.35
MAPK1 P28482 1/20 0.34
HTR3A P46098 1/20 0.34
KDM4E B2RXH2 1/20 0.33
TACR1 P25103 1/20 0.33

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
SCHEMBL13796417 0.84 ATM (0.50) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL3633864 0.81 ATM (0.51) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL3636909 0.78 CYP1A2 (0.46) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL4372822 0.78 MAOA (0.53) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL3823640 0.78 ATM (0.51) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL3634029 0.77 ATM (0.47) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL15577710 0.75 MAPK1 (0.46) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL31613919 0.75 TACR1 (0.47) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL3638874 0.74 ATM (0.42) ATML3MBTL1CYP1A2CYP2A6PDPK1
SCHEMBL3641581 0.74 ATM (0.45) ATML3MBTL1CYP1A2CYP2A6PDPK1

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-20040014687-A1 Macrolide antibacterial compounds ABBOTT LABORATORIES 2004-01-22 US claimed
US-20040014687-A1 Macrolide antibacterial compounds ABBOTT LABORATORIES 2004-01-22 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-20040014687-A1 Macrolide antibacterial compounds MRPL21, NOP2, PIGS ATM 4352/4885L3MBTL1 353/4885CYP1A2 127/4885

“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.