SCHEMBL2999863

SCHEMBL2999863

CC1(C)CN(Cc2ccccc2)CC(=Cc2cccnc2)C1=O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.69
ALDH1A1 P00352 8/20 0.69
LMNA P02545 7/20 0.69
HTT P42858 7/20 0.69
RAB9A P51151 6/20 0.69
SMN1; SMN2 Q16637 5/20 0.69
MAPK1 P28482 3/20 0.69
TP53 P04637 1/20 0.69
MITF O75030 3/20 0.48
KDM4E B2RXH2 3/20 0.46
HSP90AA1 P07900 1/20 0.46
ATM Q13315 2/20 0.45
NPC1 O15118 1/20 0.45
NSD2 O96028 1/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 1/20 0.45
THRB P10828 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
ACHE P22303 3/20 0.44
CYP19A1 P11511 3/20 0.43

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
SCHEMBL2999862 1.00 MAPT (0.69) MAPTALDH1A1LMNAHTTRAB9A
SCHEMBL3006044 0.88 ACHE (0.53) MAPTALDH1A1LMNAHTTRAB9A
SCHEMBL3006047 0.88 ACHE (0.53) MAPTALDH1A1LMNAHTTRAB9A
SCHEMBL3636696 0.80 MAPK1 (0.48) MAPTALDH1A1LMNAHTTRAB9A
SCHEMBL3636699 0.80 MAPK1 (0.48) MAPTALDH1A1LMNAHTTRAB9A
SCHEMBL2997703 0.79 ALDH1A1 (0.49) MAPTALDH1A1LMNAHTTRAB9A
SCHEMBL2997705 0.79 ALDH1A1 (0.49) MAPTALDH1A1LMNAHTTRAB9A
SCHEMBL3006677 0.78 LMNA (0.51) MAPTALDH1A1LMNAHTTRAB9A
SCHEMBL3005167 0.78 MAPT (0.50) MAPTALDH1A1LMNARAB9ASMN1; SMN2
SCHEMBL3005164 0.78 MAPT (0.50) MAPTALDH1A1LMNARAB9ASMN1; SMN2

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-20100190824-A1 Novel Substituted Piperidones as HSP Inducers TORRENT PHARMACEUTICALS LTD. (IN) 2010-07-29 US claimed

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-20100190824-A1 Novel Substituted Piperidones as HSP Inducers HSF1, HSPA4, HSPA5 MAPT 40/4885ALDH1A1 541/4885LMNA 4156/4885

“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.