SCHEMBL8247744

SCHEMBL8247744

CCCCCCNc1c(Cl)cnn(-c2ccccc2)c1=O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.63
▸ RAB9A P51151 4/20 0.63
▸ KDM4E B2RXH2 2/20 0.63
▸ NPBWR1 P48145 5/20 0.56
▸ MCHR1 Q99705 3/20 0.56
▸ MAPT P10636 4/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ HTT P42858 2/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ MITF O75030 1/20 0.51
▸ S1PR4 O95977 1/20 0.51
▸ THRB P10828 1/20 0.51
▸ XBP1 P17861 1/20 0.51
▸ S1PR1 P21453 1/20 0.51
▸ PAX8 Q06710 1/20 0.51
▸ GAA P10253 1/20 0.50
▸ NPSR1 Q6W5P4 4/20 0.46
▸ SOAT2 O75908 2/20 0.46
▸ SOAT1 P35610 2/20 0.46
▸ LMNA P02545 2/20 0.46

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
SCHEMBL19000704 0.95 SMN1; SMN2 (0.70) SMN1; SMN2RAB9AKDM4ENPBWR1MCHR1
SCHEMBL8243863 0.83 RAB9A (0.91) SMN1; SMN2RAB9AKDM4EMAPTALDH1A1
SCHEMBL8242081 0.75 SMN1; SMN2 (0.73) SMN1; SMN2RAB9AKDM4EMAPTALDH1A1
SCHEMBL9982965 0.73 BPTF (0.68) SMN1; SMN2RAB9AKDM4EMAPTHTT
SCHEMBL11943614 0.73 MAPT (0.48) SMN1; SMN2RAB9AKDM4EMAPTALDH1A1
SCHEMBL11943603 0.73 MAPT (0.48) SMN1; SMN2RAB9AKDM4EMAPTALDH1A1
SCHEMBL11943598 0.73 MAPT (0.48) SMN1; SMN2RAB9AKDM4EMAPTALDH1A1
SCHEMBL11946583 0.73 ALDH1A1 (0.61) SMN1; SMN2RAB9AKDM4EMAPTALDH1A1
SCHEMBL8245374 0.73 SMN1; SMN2 (0.66) SMN1; SMN2RAB9AKDM4EMAPTALDH1A1
SCHEMBL17074602 0.72 RAB9A (0.85) SMN1; SMN2RAB9AKDM4EMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090012088-A1 Compounds for the Treatment of Neurodegeneration and Stroke THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2009-01-08 — — US disclosed
US-20090012088-A1 Compounds for the Treatment of Neurodegeneration and Stroke THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2009-01-08 — — US disclosed
US-20070032496-A1 Compounds for the Treatment of Neurodegeneration and Stroke THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2007-02-08 — — US disclosed
US-20070032496-A1 Compounds for the Treatment of Neurodegeneration and Stroke THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2007-02-08 — — US disclosed
WO-2007014226-A2 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATION AND STROKE THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-02-01 — — 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 (2 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-20070032496-A1 Compounds for the Treatment of Neurodegeneration and Stroke PARP1, PARP12, PARP11 SMN1; SMN2 89/4885RAB9A 2534/4885KDM4E 3160/4885
US-20090012088-A1 Compounds for the Treatment of Neurodegeneration and Stroke PARP1, PARP12, PARP11 SMN1; SMN2 89/4885RAB9A 2534/4885KDM4E 3160/4885

“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.

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