SCHEMBL3241985

SCHEMBL3241985

CCCOC(=O)c1c[nH]c2c(=O)[nH]c3ccc(S(=O)(=O)N(C)C4CCNCC4)cc3c12

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
ALDH1A1 P00352 4/20 0.42
HPGD P15428 3/20 0.42
LMNA P02545 2/20 0.42
KDM4E B2RXH2 4/20 0.38
HSD17B10 Q99714 3/20 0.38
PLAT P00750 1/20 0.37
USP2 O75604 2/20 0.36
RXFP1 Q9HBX9 1/20 0.36
POLB P06746 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
TP53 P04637 2/20 0.35
ESR1 P03372 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
SCHEMBL3250843 0.95 MAPT (0.44) MAPTALDH1A1HPGDLMNAKDM4E
SCHEMBL3254222 0.91 MAPT (0.41) MAPTALDH1A1HPGDLMNAKDM4E
SCHEMBL3247591 0.91 ALDH1A1 (0.41) MAPTALDH1A1HPGDLMNAKDM4E
SCHEMBL13928160 0.91 MAPT (0.42) MAPTALDH1A1HPGDLMNAKDM4E
SCHEMBL13928184 0.88 SLC6A2 (0.45) MAPTALDH1A1HPGDLMNAKDM4E
Hydrochloric Acid SCHEMBL3247383 0.88 SLC6A2 (0.45) MAPTALDH1A1HPGDLMNAKDM4E
SCHEMBL3245465 0.87 ALDH1A1 (0.36) MAPTALDH1A1HPGDLMNAKDM4E
SCHEMBL3247121 0.86 GAA (0.44) MAPTALDH1A1HPGDLMNAKDM4E
SCHEMBL3250747 0.85 PARG (0.43) MAPTALDH1A1LMNAKDM4EHSD17B10
SCHEMBL3251345 0.84 KDM4E (0.38) MAPTALDH1A1HPGDLMNAKDM4E

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
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
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 MAPT 734/4885ALDH1A1 3830/4885HPGD 882/4885

“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.