SCHEMBL4285505

SCHEMBL4285505

Cn1cc(NC(=O)COc2ccccc2)cn1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.64
MAPT P10636 2/20 0.64
LMNA P02545 1/20 0.58
NOTUM Q6P988 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.57
HTT P42858 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
PDE6D O43924 2/20 0.56
NPC1 O15118 5/20 0.54
RAB9A P51151 4/20 0.54
MAPK1 P28482 1/20 0.54
GAA P10253 1/20 0.54
PORCN Q9H237 1/20 0.53
TP53 P04637 1/20 0.52

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
SCHEMBL21533437 0.87 L3MBTL1 (0.62) ALDH1A1MAPTLMNASMN1; SMN2HTT
SCHEMBL22775067 0.80 ALDH1A1 (0.67) ALDH1A1MAPTSMN1; SMN2HTTL3MBTL1
SCHEMBL15890215 0.79 ALDH1A1 (0.55) ALDH1A1MAPTLMNASMN1; SMN2HTT
SCHEMBL3498895 0.77 LMNA (0.78) ALDH1A1MAPTLMNANOTUMSMN1; SMN2
SCHEMBL31503975 0.77 LMNA (0.78) ALDH1A1MAPTLMNANOTUMNPC1
SCHEMBL4283172 0.77 ALDH1A1 (0.63) ALDH1A1MAPTSMN1; SMN2HTTL3MBTL1
SCHEMBL4288489 0.77 MAPT (0.60) ALDH1A1MAPTLMNASMN1; SMN2HTT
SCHEMBL4279669 0.75 EGFR (0.63) NPC1RAB9ATP53
SCHEMBL4288020 0.75 KMT2A (0.62) ALDH1A1LMNASMN1; SMN2HTTL3MBTL1
SCHEMBL25020926 0.75 ALDH1A1 (0.73) ALDH1A1MAPTSMN1; SMN2HTTL3MBTL1

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-20090156582-A1 Pyrazole Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 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-20090156582-A1 Pyrazole Compound GSK3B, GSK3A, GSKIP ALDH1A1 694/4885MAPT 868/4885LMNA 2198/4885

“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.