SCHEMBL23707124

SCHEMBL23707124

CCc1cccn2c(C)ncc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.39
MAPT P10636 2/20 0.39
TNKS O95271 2/20 0.36
PARP1 P09874 2/20 0.36
TNKS2 Q9H2K2 2/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
PDE1A P54750 2/20 0.33
PDE1C Q14123 2/20 0.33
PDE2A O00408 1/20 0.33
PDE6D O43924 1/20 0.33
PDE8A O60658 1/20 0.33
PDE5A O76074 1/20 0.33
PDE9A O76083 1/20 0.33
PDE8B O95263 1/20 0.33
PDE6A P16499 1/20 0.33
PDE6G P18545 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
SCHEMBL11175719 0.85 BAZ2B (0.37) TP53MAPTPDE1APDE1CPDE10A
SCHEMBL11175715 0.79 ATP4A (0.51) TP53MAPTCYP3A4CYP2D6CYP2C19
SCHEMBL12670774 0.77 SSTR4 (0.40) KDM4EALDH1A1GLAGAAHPGD
Hydrochloric Acid SCHEMBL11171338 0.77 ATP4A (0.49) TP53MAPTCYP3A4CYP2D6CYP2C19
SCHEMBL24047709 0.76 SSTR4 (0.36) GABRA1GABRB2
SCHEMBL23104811 0.74 LCK (0.38) MAPTTNKSPARP1TNKS2KDM4E
SCHEMBL25045782 0.74 KDM4E (0.38) MAPTTNKSPARP1TNKS2CYP3A4
SCHEMBL13556619 0.73 TSHR (0.51) TP53MAPTCYP1A2CYP3A4CYP2D6
SCHEMBL24047715 0.73 SSTR4 (0.41)
SCHEMBL23108726 0.71 CYP1A2 (0.38) TP53MAPTCYP1A2CYP3A4CYP2D6

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-11078201-B2 Substituted isoindolin-1-ones and 2,3-dihydro-1H-pyrrol[3,4-c]pyridin-1-ones as HPK1 antagonists Nimbus Saturn, Inc. (US) 2021-08-03 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-11078201-B2 Substituted isoindolin-1-ones and 2,3-dihydro-1H-pyrrol[3,4-c]pyridin-1-ones as HPK1 antagonists HIPK1, PDXK, IP6K1 TP53 2193/4885MAPT 3099/4885TNKS 76/4885

“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.