SCHEMBL13102472

SCHEMBL13102472

CCc1nc2c(C3CC3)cccc2c(=O)n1NC(=O)Cc1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
LMNA P02545 4/20 0.41
HTT P42858 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
RXFP1 Q9HBX9 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
GAA P10253 1/20 0.36
SIGMAR1 Q99720 2/20 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
SCHEMBL13102514 0.91 NPSR1 (0.46) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL13102268 0.89 ALDH1A1 (0.48) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL13102473 0.88 SMN1; SMN2 (0.43) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL13102405 0.86 ALDH1A1 (0.45) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL13101673 0.86 ALDH1A1 (0.45) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL3058348 0.85 ALDH1A1 (0.47) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL13101631 0.84 ALDH1A1 (0.44) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL13101958 0.83 ALDH1A1 (0.43) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL13101964 0.82 ALDH1A1 (0.43) ALDH1A1LMNAHTTKMT2AMEN1
SCHEMBL13101640 0.82 ALDH1A1 (0.43) ALDH1A1LMNAHTTKMT2AMEN1

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-8329713-B2 Fused ring heterocycles as potassium channel modulators ICAGEN INC. (US) 2012-12-11 US disclosed
US-20100273784-A1 FUSED RING HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS ICAGEN, INC. (US) 2010-10-28 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-20100273784-A1 FUSED RING HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS KCNK17, KCNJ2, KCNJ1 ALDH1A1 2354/4885LMNA 1121/4885HTT 329/4885

“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.