SCHEMBL4153846

SCHEMBL4153846

CS(=O)(=O)c1cccc(-c2ccc3[nH]c(=O)c4[nH]cc(CCCC(=O)O)c4c3c2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMKK2 Q96RR4 2/20 0.39
FASN P49327 1/20 0.37
PDPK1 O15530 1/20 0.36
IKBKB O14920 1/20 0.36
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
PTGS2 P35354 5/20 0.34
PIM1 P11309 1/20 0.34
ICMT O60725 1/20 0.34
GRK6 P43250 1/20 0.34
F7 P08709 1/20 0.34
SERPINE1 P05121 1/20 0.34
S1PR1 P21453 1/20 0.34
ATM Q13315 1/20 0.34
SPR P35270 1/20 0.33

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
SCHEMBL4155339 0.94 CAMKK2 (0.40) CAMKK2FASNPDPK1IKBKBGRIN2D
SCHEMBL4155187 0.86 HPGD (0.38) IKBKBPTGS2ICMTSPR
SCHEMBL3242761 0.82 CAMKK2 (0.46) CAMKK2FASNPDPK1PTGS2
SCHEMBL4159323 0.81 FASN (0.45) CAMKK2FASNGRK6F7S1PR1
SCHEMBL4153837 0.81 GPR17 (0.45) IKBKBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4161892 0.81 TDP2 (0.39) CAMKK2SPR
SCHEMBL4157978 0.80 HPGD (0.39) IKBKBF7S1PR1SPR
SCHEMBL4166164 0.80 GPR17 (0.40) IKBKBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4157563 0.79 HPGD (0.49) IKBKBGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4169887 0.79 KDM4E (0.55)

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
US-8426437-B2 Pyrroloquinoline derivatives and their use as protein kinases inhibitors PIERRE FABRE MEDICAMENT (FR) 2013-04-23 US claimed
US-20090042876-A1 Pyrroloquinoline Derivatives And Their Use As Protein Kinases Inhibitors PIERRE FABRE MEDICAMENT (FR) 2009-02-12 US claimed
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 CAMKK2 43/4885FASN 2527/4885PDPK1 23/4885

“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.