SCHEMBL880285

SCHEMBL880285

O=C1CC(c2ccc(Cl)cc2)c2c(cccc2-c2ccccc2)N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.47
CREBBP Q92793 5/20 0.47
TP53 P04637 3/20 0.46
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
GPBAR1 Q8TDU6 2/20 0.43
ALDH1A1 P00352 3/20 0.43
SIRT2 Q8IXJ6 1/20 0.43
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
TNKS2 Q9H2K2 1/20 0.43
CNR1 P21554 1/20 0.40
NTSR1 P30989 1/20 0.40
OPRK1 P41145 1/20 0.40
PDE4D Q08499 1/20 0.40
LMNA P02545 2/20 0.39
GAA P10253 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL880452 0.90 CREBBP (0.52) BRD4CREBBPTP53POLBMAPT
SCHEMBL10280719 0.81 TP53 (0.45) BRD4CREBBPTP53MAPTGPBAR1
SCHEMBL10280613 0.78 TP53 (0.57) BRD4CREBBPTP53MAPTGPBAR1
SCHEMBL880444 0.77 TP53 (0.59) TP53POLBMAPTGPBAR1ALDH1A1
SCHEMBL880275 0.75 TP53 (0.57) TP53POLBMAPTGPBAR1ALDH1A1
SCHEMBL880443 0.75 TP53 (0.76) TP53POLBMAPTALDH1A1SIRT2
SCHEMBL9864707 0.70 CYP19A1 (0.68) TP53POLBMAPTGPBAR1ALDH1A1
SCHEMBL880477 0.70 BRD4 (0.48) BRD4CREBBPMAPTALDH1A1SIRT2
SCHEMBL880262 0.69 TDP1 (0.53) CREBBPALDH1A1KMT2ALMNAGAA
SCHEMBL880451 0.68 LMNA (0.47) TP53POLBMAPTSIRT2MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440705-B2 2,3,4,7,8,9-hexahydro-1H-cyclopenta[h]quinolin-2-one or 2,3,4,6,7,8-hexahydro-1H-cyclopenta[g]quinolin-2-one; Alzheimer's disease WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2013-05-14 US disclosed
EP-2433634-A2 Compounds, compositions and methods of inhibiting a-synuclein toxicity The Whitehead Institute for Biomedical Research (US) 2012-03-28 EP disclosed
US-20080261953-A1 Compounds, Compositions and Methods of Inhibiting Alpha-Synuclein Toxicity WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2008-10-23 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-20080261953-A1 Compounds, Compositions and Methods of Inhibiting Alpha-Synuclein Toxicity SNCA, PARK7, HTT BRD4 1019/4885CREBBP 723/4885TP53 1529/4885

“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.