SCHEMBL3245553

SCHEMBL3245553

CCOC(=O)c1c[nH]c2c(=O)[nH]c3ccc(-c4csc(Nc5c(Cl)cccc5Cl)n4)cc3c12

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
MAPT P10636 4/20 0.43
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
KDM4E B2RXH2 3/20 0.40
DHODH Q02127 1/20 0.40
JAK2 O60674 7/20 0.39
JAK3 P52333 7/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PARP1 P09874 2/20 0.39
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38
CLEC4M Q9H2X3 1/20 0.38
GAA P10253 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL3241923 0.92 MAPT (0.53) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL3249037 0.89 ALOX5 (0.43) ALDH1A1MAPTMEN1KMT2ADHODH
SCHEMBL3253176 0.89 MEN1 (0.44) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL3253478 0.88 CSNK2A2 (0.41) MAPTPARP1GAA
SCHEMBL3253872 0.88 PARP1 (0.41) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL3254695 0.85 ABL1 (0.46) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL3251297 0.85 MEN1 (0.43) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL3251009 0.84 PARP1 (0.47) MAPTJAK2JAK3SMN1; SMN2PARP1
SCHEMBL3249681 0.83 PARP1 (0.44) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL3249830 0.82 CDK5 (0.49) ALDH1A1MAPTMEN1KMT2AJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP claimed
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US disclosed
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US disclosed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 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-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors MAP3K1, MAP3K2, MAP3K7 ALDH1A1 3830/4885MAPT 734/4885MEN1 3749/4885

“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.