SCHEMBL3206774

SCHEMBL3206774

Cc1cc2c(-c3ccc(NC(=O)O)cc3)ccnc2n1S(=O)(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 3/20 0.49
PTGDR2 Q9Y5Y4 4/20 0.45
CKS1B P61024 1/20 0.40
SKP2 Q13309 1/20 0.40
KIT P10721 3/20 0.39
CSF1R P07333 1/20 0.39
BLK P51451 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
IKBKB O14920 2/20 0.38
CHUK O15111 2/20 0.38
TOP2A P11388 1/20 0.38
GAA P10253 1/20 0.38
CYP2C9 P11712 1/20 0.38
NAMPT P43490 1/20 0.38
PDGFRA P16234 2/20 0.37
KDR P35968 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
HTR6 P50406 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL3413045 0.89 PIK3C3 (0.44) PIK3C3PTGDR2IKBKBCHUKHTR6
SCHEMBL3416118 0.87 CHUK (0.53) PIK3C3PTGDR2CKS1BSKP2MEN1
SCHEMBL13505139 0.86 PTGDR2 (0.46) PIK3C3PTGDR2CKS1BSKP2MEN1
SCHEMBL3414679 0.84 PTGDR2 (0.43) PIK3C3PTGDR2IKBKBCHUKHTR6
SCHEMBL30134914 0.82 PIK3C3 (0.39) PIK3C3PTGDR2
SCHEMBL30135081 0.82 PIK3C3 (0.39) PIK3C3PTGDR2
SCHEMBL3418350 0.80 IKBKB (0.54) PIK3C3MEN1KMT2AIKBKBCHUK
SCHEMBL3414803 0.80 IKBKB (0.53) PIK3C3PTGDR2MEN1KMT2AIKBKB
SCHEMBL30134894 0.79 BCL2 (0.48) CYP3A4
SCHEMBL30135114 0.79 EGFR (0.45) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100041891-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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-20100041891-A1 AMIDE COMPOUND GPR52, GPR132, NR5A2 PIK3C3 4327/4885PTGDR2 490/4885CKS1B 2192/4885

“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.