SCHEMBL7120142

SCHEMBL7120142

O=c1nc(Cc2ccc3ccccc3c2)[nH]c2nc[nH]c12

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.39
ADORA2B P29275 1/20 0.39
HTR6 P50406 1/20 0.38
PDE10A Q9Y233 1/20 0.38
CYP2D6 P10635 1/20 0.37
NFKB1 P19838 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
ALKBH3 Q96Q83 1/20 0.37
DAO P14920 2/20 0.37
PNP P00491 1/20 0.36
BACE1 P56817 1/20 0.36
CTRC Q99895 1/20 0.36
NPC1 O15118 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MPO P05164 1/20 0.36

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
SCHEMBL28817761 0.85 ADORA3 (0.49) ADORA3ADORA2BTAAR1DAOPNP
SCHEMBL7977497 0.83 ADORA3 (0.42) ADORA3ADORA2BALKBH3PNP
SCHEMBL7117259 0.76 CDC7 (0.43) LMNA
SCHEMBL11133896 0.71 ADORA2A (0.47) ADORA3ADORA2BSMN1; SMN2
SCHEMBL3757595 0.69 ALDH1A1 (0.50) ADORA3ADORA2BTAAR1PNPMAPT
SCHEMBL13607804 0.68 LMNA (0.42) HTR6PDE10ACYP2D6NFKB1TAAR1
SCHEMBL27582729 0.67 TAAR1 (0.64) CYP2D6NFKB1TAAR1LMNASMN1; SMN2
SCHEMBL7680705 0.67 PDE4A (0.49) ADORA3ADORA2B
SCHEMBL4966795 0.67 PNP (0.74) PNP
SCHEMBL30902073 0.66 SMN1; SMN2 (0.69) HTR6ALKBH3NPC1LMNAMAPT

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-20030186978-A1 Novel telomerase inhibitors PHARMACIA ITALIA, SPA (IT) 2003-10-02 US claimed
WO-2001096339-A1 NOVEL TELOMERASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2001-12-20 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-20030186978-A1 Novel telomerase inhibitors TERT, TERF2IP, TERF2 ADORA3 4545/4885ADORA2B 4616/4885HTR6 4380/4885

“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.