SCHEMBL7128664

SCHEMBL7128664

O=C1Cc2cc(S(=O)(=O)Cc3ccc(C(F)(F)F)cc3)ccc2N1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.58
KIF11 P52732 4/20 0.49
PKM P14618 2/20 0.46
PKLR P30613 1/20 0.46
MAOB P27338 2/20 0.44
CDK2 P24941 2/20 0.44
AKT1 P31749 2/20 0.44
CDK1 P06493 1/20 0.44
KIT P10721 1/20 0.44
KDR P35968 1/20 0.44
TDP2 O95551 1/20 0.42
SMYD3 Q9H7B4 1/20 0.42
IDO1 P14902 1/20 0.42

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
SCHEMBL7122922 0.90 GAA (0.53) GAAKIF11PKMPKLRMAOB
SCHEMBL7127344 0.87 GAA (0.58) GAAKIF11PKMPKLR
SCHEMBL3135008 0.86 MAOB (0.60) GAAPKMMAOBSMYD3IDO1
SCHEMBL7126895 0.85 MAOB (0.50) GAAPKMMAOBSMYD3IDO1
SCHEMBL7125541 0.84 GAA (0.52) GAAKIF11PKMPKLRTDP2
SCHEMBL3249974 0.83 GAA (0.54) GAAPKMMAOBCDK2SMYD3
SCHEMBL24152535 0.82 GAA (0.55) GAAKIF11PKMPKLRSMYD3
SCHEMBL7122906 0.81 MLNR (0.49) GAAPKMMAOBSMYD3IDO1
SCHEMBL7114642 0.81 GAA (0.50) GAAPKMMAOBSMYD3IDO1
SCHEMBL7116155 0.81 GAA (0.58) GAAPKMMAOBTDP2SMYD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6599902-B2 For treating or preventing a protein kinase related disorder SUGEN, INC. 2003-07-29 US disclosed
US-20030125370-A1 5-ARALKYSUFONYL-3-(PYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS SUGEN, INC. 2003-07-03 US disclosed
WO-2002096361-A2 5-ARALKYLSULFONYL-3- (PYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS SUGEN, INC. (US) 2002-12-05 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-20030125370-A1 5-ARALKYSUFONYL-3-(PYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS DMPK, ADK, MAP3K20 GAA 2267/4885KIF11 3476/4885PKM 563/4885

“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.