SCHEMBL613137

SCHEMBL613137

COc1ccc2[nH]c3c(C)c4cc[nH]c(=O)c4c(C)c3c2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.68
LIMK2 P53671 1/20 0.68
KDM4E B2RXH2 4/20 0.55
MAPT P10636 4/20 0.55
RAB9A P51151 3/20 0.55
RECQL P46063 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
PKM P14618 2/20 0.55
NPSR1 Q6W5P4 2/20 0.55
TLR3 O15455 1/20 0.55
NR3C1 P04150 1/20 0.55
POLB P06746 1/20 0.55
KIT P10721 1/20 0.55
DYRK1A Q13627 3/20 0.54
TDP1 Q9NUW8 1/20 0.54
PDGFRB P09619 1/20 0.52
STING1 Q86WV6 1/20 0.50
GSK3A P49840 2/20 0.48
GSK3B P49841 2/20 0.48

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
SCHEMBL614498 0.82 LIMK1 (0.67) LIMK1LIMK2KDM4EMAPTNPSR1
SCHEMBL31061690 0.82 LIMK1 (0.61) LIMK1LIMK2KITDYRK1AGSK3A
SCHEMBL614767 0.82 LIMK1 (0.61) LIMK1LIMK2KITDYRK1AGSK3A
SCHEMBL612219 0.81 LIMK1 (1.00) LIMK1LIMK2KDM4EMAPTRAB9A
SCHEMBL11077910 0.81 STING1 (0.54) LIMK1LIMK2KDM4EMAPTRAB9A
SCHEMBL16009072 0.80 ALDH1A1 (0.59) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL1656578 0.80 ALDH1A1 (0.59) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL614782 0.78 KDM4E (0.53) LIMK1LIMK2KDM4EMAPTRAB9A
SCHEMBL10547752 0.76 DYRK1A (0.59) KDM4EMAPTRAB9ARECQLMEN1
SCHEMBL9736132 0.75 KDM4E (0.65) KDM4EMAPTRAB9ARECQLMEN1

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-8604048-B2 Pyridocarbazole type compounds and applications thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-12-10 US disclosed
US-20120041017-A1 PYRIDOCARBAZOLE TYPE COMPOUNDS AND APPLICATIONS THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-02-16 US disclosed
US-20120041017-A1 PYRIDOCARBAZOLE TYPE COMPOUNDS AND APPLICATIONS THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-02-16 US disclosed
US-20120041017-A1 PYRIDOCARBAZOLE TYPE COMPOUNDS AND APPLICATIONS THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-02-16 US disclosed
WO-2010095042-A2 PYRIDOCARBAZOLE TYPE COMPOUNDS AND APPLICATIONS THEREOF CENTRE NATONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-08-26 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 (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-20120041017-A1 PYRIDOCARBAZOLE TYPE COMPOUNDS AND APPLICATIONS THEREOF NLN, OPA1, PYCR1 LIMK1 2270/4885LIMK2 2037/4885KDM4E 3884/4885

“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.