SCHEMBL614498

SCHEMBL614498

Cc1c2cc[nH]c(=O)c2c(C)c2c1[nH]c1ccc(OCc3ccccc3)cc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.67
LIMK2 P53671 1/20 0.67
MAOA P21397 3/20 0.52
MAOB P27338 2/20 0.52
CHEK1 O14757 1/20 0.49
CTSV O60911 3/20 0.47
CTSL P07711 3/20 0.47
TRPM8 Q7Z2W7 1/20 0.47
KDM4E B2RXH2 2/20 0.46
MAPT P10636 2/20 0.46
CDK4 P11802 1/20 0.46
CCND1 P24385 1/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
NSD2 O96028 1/20 0.45
ABL1 P00519 1/20 0.45
PPARG P37231 1/20 0.45
RIN1 Q13671 1/20 0.45

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
SCHEMBL7899171 0.91 LIMK1 (0.56) LIMK1LIMK2MAOAMAOBCHEK1
SCHEMBL615545 0.84 MAOA (0.53) LIMK1LIMK2MAOAMAOBCHEK1
SCHEMBL613137 0.82 LIMK1 (0.68) LIMK1LIMK2KDM4EMAPTHPGD
SCHEMBL612219 0.80 LIMK1 (1.00) LIMK1LIMK2CHEK1KDM4EMAPT
SCHEMBL614767 0.77 LIMK1 (0.61) LIMK1LIMK2CHEK1HPGDSMN1; SMN2
SCHEMBL31061690 0.77 LIMK1 (0.61) LIMK1LIMK2CHEK1HPGDSMN1; SMN2
SCHEMBL5879186 0.76 MAOA (0.58) MAOAMAOBCHEK1CTSVCTSL
SCHEMBL11160990 0.76 KIT (0.69) MAOACHEK1TRPM8KDM4EMAPT
SCHEMBL31362095 0.76 KIT (0.69) MAOACHEK1TRPM8KDM4EMAPT
SCHEMBL10022322 0.74 CHEK1 (0.48) MAOAMAOBCHEK1CTSVCTSL

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 2037/4885MAOA 331/4885

“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.