SCHEMBL6506725

SCHEMBL6506725

CSC1=N[C@H](c2ccccc2)CN1c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ATM Q13315 1/20 0.51
NPC1 O15118 1/20 0.43
ALPL P05186 2/20 0.39
TSHR P16473 2/20 0.39
ALPI P09923 1/20 0.39
ADRA2B P18089 1/20 0.39
DRD1 P21728 1/20 0.39
KCNH2 Q12809 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
ALOX12 P18054 1/20 0.39
NFKB1 P19838 1/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
PMP22 Q01453 1/20 0.38
BLM P54132 1/20 0.38
GSK3B P49841 1/20 0.37

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
SCHEMBL6499602 1.00 MEN1 (0.51) MEN1KMT2AATMNPC1ALPL
Iodide SCHEMBL3258439 0.98 MEN1 (0.50) MEN1KMT2AATMNPC1ALPL
Iodide SCHEMBL3259488 0.98 MEN1 (0.50) MEN1KMT2AATMNPC1ALPL
SCHEMBL11186239 0.73 MEN1 (0.61) MEN1KMT2AATMNPC1ALPL
SCHEMBL29018052 0.70 MEN1 (0.68) MEN1KMT2AATMNPC1ALPL
SCHEMBL28801759 0.68 MEN1 (0.54) MEN1KMT2AATMNPC1ALPL
SCHEMBL5731330 0.67 MEN1 (0.44) MEN1KMT2AATMNPC1ALPL
SCHEMBL5537574 0.66 BPTF (0.47) MEN1KMT2AATMNPC1ALPL
Trifluoroacetic Acid SCHEMBL3256428 0.66 MEN1 (0.43) MEN1KMT2AATMNPC1TAAR1
Trifluoroacetic Acid SCHEMBL3255747 0.66 MEN1 (0.43) MEN1KMT2AATMNPC1TAAR1

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-20050026916-A1 Heterocyclic compounds as P2X7 ion channel blockers AVENTIS PHARMACEUTICALS INC. (US) 2005-02-03 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-20050026916-A1 Heterocyclic compounds as P2X7 ion channel blockers P2RX3, P2RX2, P2RX5 MEN1 3313/4885KMT2A 3229/4885ATM 4261/4885

“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.