SCHEMBL4155522

SCHEMBL4155522

Cc1n[nH]c2cc(Oc3cccc(S(C)(=O)=O)c3)ccc12

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 12/20 0.45
NR1H3 Q13133 11/20 0.45
GCK P35557 2/20 0.43
CHEK1 O14757 1/20 0.41
FGFR1 P11362 1/20 0.41
KDR P35968 1/20 0.41
RXRA P19793 1/20 0.41
PTGS1 P23219 3/20 0.41
PTGS2 P35354 3/20 0.41
LRRK2 Q5S007 1/20 0.41

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
SCHEMBL4144286 0.81 ALDH1A1 (0.49) CHEK1FGFR1KDR
SCHEMBL16576449 0.81 KDR (0.59) CHEK1FGFR1KDR
SCHEMBL12907444 0.80 TTK (0.54) NR1H2NR1H3LRRK2
SCHEMBL4144767 0.79 KIT (0.48) GCKCHEK1FGFR1KDR
SCHEMBL4144602 0.76 KDR (0.43) CHEK1FGFR1KDR
SCHEMBL27805303 0.76 KDR (0.47) CHEK1FGFR1KDR
SCHEMBL8738326 0.74 HTT (0.64) NR1H2NR1H3GCKPTGS2
SCHEMBL2448984 0.74 KDR (0.45) GCKCHEK1FGFR1KDRPTGS1
SCHEMBL16566280 0.73 HTT (0.61) NR1H2NR1H3GCKPTGS1PTGS2
SCHEMBL12907464 0.72 SGK1 (0.51) FGFR1KDRLRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090143422-A1 P38 INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2009-06-04 US claimed
EP-2039685-A2 Heterobicyclic compounds as P38 inhibitors Array Biopharma, Inc. (US) 2009-03-25 EP claimed

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-20090143422-A1 P38 INHIBITORS AND METHODS OF USE THEREOF MAPKAPK2, MAPK1, MAPK8 NR1H2 292/4885NR1H3 279/4885GCK 1901/4885

“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.