SCHEMBL8039239

SCHEMBL8039239

CC1C2CC(CC1c1cccnc1)N(Cc1ccccc1)C2

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.53
MDM2 Q00987 1/20 0.53
MAPT P10636 2/20 0.40
KDM1A O60341 2/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
CYP2A6 P11509 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HTT P42858 2/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39
POLB P06746 1/20 0.38
TRPV6 Q9H1D0 1/20 0.38

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
SCHEMBL13850677 0.78 SLC6A4 (0.46) MAPTKDM1AMAOAMAOB
SCHEMBL14373087 0.70 TP53 (1.00) TP53MDM2MAPTALDH1A1HTT
SCHEMBL3043200 0.69 CHRNB2 (0.52) TP53MDM2
SCHEMBL10635883 0.67 MAPT (0.43) MAPT
SCHEMBL731775 0.67 MAPT (0.54) MAPT
SCHEMBL28502868 0.66 ALDH1A1 (0.72) TP53MDM2MAPTCYP2A6ALDH1A1
SCHEMBL28503664 0.66 ALDH1A1 (0.72) TP53MDM2MAPTCYP2A6ALDH1A1
SCHEMBL29683884 0.66 ALDH1A1 (0.72) TP53MDM2MAPTCYP2A6ALDH1A1
SCHEMBL28508997 0.66 ALDH1A1 (0.72) TP53MDM2MAPTCYP2A6ALDH1A1
SCHEMBL6956567 0.66 TP53 (0.54) TP53MDM2MAPTALDH1A1HTT

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-20090118326-A1 Nicotinic Acetylcholine Receptor Modulators NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-05-07 US disclosed
WO-2009058120-A1 NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS SRI INTERNATIONAL (US) 2009-05-07 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-20090118326-A1 Nicotinic Acetylcholine Receptor Modulators CHRNA10, CHRNA6, CHRNA5 TP53 2482/4885MDM2 2759/4885MAPT 434/4885

“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.