SCHEMBL6869694

SCHEMBL6869694

O=C1NC(=O)C2=C1c1c([nH]c3ccccc13)CCCc1[nH]c3ccccc3c1C1=C(C(=O)NC1=O)N1CCC(CCCCCCC3CCN2CC3)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCB P05771 2/20 0.39
PRKCA P17252 1/20 0.39
PRKCH P24723 1/20 0.39
PRKCE Q02156 1/20 0.39
PRKCQ Q04759 1/20 0.39
PRKCD Q05655 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
GSK3B P49841 1/20 0.37
PARP1 P09874 2/20 0.37
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
RB1 P06400 2/20 0.36
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
CASP1 P29466 1/20 0.36
ATM Q13315 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CDK4 P11802 3/20 0.34
CCND1 P24385 3/20 0.34
DRD2 P14416 1/20 0.34

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
SCHEMBL6867963 0.97 PRKCB (0.39) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL6865204 0.96 SMN1; SMN2 (0.41) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL6867242 0.96 PARP1 (0.38) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL6866361 0.95 SMN1; SMN2 (0.41) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL6871060 0.90 PARP1 (0.39) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL6867238 0.89 SMN1; SMN2 (0.42) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL6867314 0.88 SMN1; SMN2 (0.47) PRKCBPRKCAPRKCHPRKCEPRKCQ
SCHEMBL6866820 0.84 SMN1; SMN2 (0.38) SMN1; SMN2KDM4EALDH1A1RB1MAPT
SCHEMBL6865623 0.84 SMN1; SMN2 (0.38) SMN1; SMN2KDM4EALDH1A1RB1MAPT
SCHEMBL6871061 0.82 SMN1; SMN2 (0.40) SMN1; SMN2GSK3BKDM4EALDH1A1RB1

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-6812243-B2 AS TYROSINE KINASE INHIBITORS; FOR THERARPY OF TUMORS, ARTERIOSCLEROSIS, RESTENOSIS AFTER BALLOON ANGIOPLASTY, ARTHRITIS AND FIBROTIC DISEASES ZENTARIS AG (DE) 2004-11-02 US disclosed
US-20030008898-A1 Indole derivatives and their use for the treatment of malignant and other diseases based on pathological proliferation ZENTARIS AG (DE) 2003-01-09 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-20030008898-A1 Indole derivatives and their use for the treatment of malignant and other diseases based on pathological proliferation MKI67, IDO1, CCNI PRKCB 1147/4885PRKCA 1381/4885PRKCH 915/4885

“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.