SCHEMBL2835389

SCHEMBL2835389

Cc1cc(C(F)(F)F)cnc1NCC(=O)NN

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
GAA P10253 4/20 0.47
POLB P06746 2/20 0.47
ALDH1A1 P00352 5/20 0.47
AGBL2 Q5U5Z8 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.43
RAB9A P51151 2/20 0.42
LMNA P02545 2/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C19 P33261 2/20 0.41
KDM4E B2RXH2 2/20 0.41
CYP2D6 P10635 1/20 0.40

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
SCHEMBL2838831 0.84 ALDH1A1 (0.50) L3MBTL1GAAPOLBALDH1A1AGBL2
SCHEMBL4368849 0.75 AGBL2 (0.44) L3MBTL1GAAPOLBALDH1A1AGBL2
SCHEMBL18376268 0.75 IL1B (0.49) L3MBTL1GAAPOLBALDH1A1AGBL2
SCHEMBL15945544 0.71 POLB (0.46) L3MBTL1GAAPOLBALDH1A1AGBL2
SCHEMBL6985291 0.70 AGBL2 (0.45) L3MBTL1GAAPOLBALDH1A1AGBL2
SCHEMBL15922616 0.69 SMN1; SMN2 (0.53) GAAALDH1A1AGBL2SMN1; SMN2RAB9A
SCHEMBL30366829 0.68 CA1 (0.56) L3MBTL1POLBALDH1A1SMN1; SMN2RAB9A
SCHEMBL24612069 0.67 CFTR (0.49) L3MBTL1GAAPOLBALDH1A1AGBL2
SCHEMBL30366730 0.67 ALDH1A1 (0.61) L3MBTL1GAAALDH1A1SMN1; SMN2RAB9A
SCHEMBL14783550 0.66 CFTR (0.65) GAAPOLBALDH1A1AGBL2SMN1; SMN2

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-20100168101-A1 OXINDOLE HYDRAZIDE MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2010-07-01 US disclosed
US-7696231-B2 Oxindole hydrazide modulators of protein tyrosine phosphatases (PTPs) LABORATOIRES SERONO SA (CH) 2010-04-13 US disclosed
US-20050043388-A1 Oxindole hydrazide modulators of protein tyrosine phosphatases (ptps) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. 2005-02-24 US disclosed
EP-1439834-A1 OXINDOLE HYDRAZIDE MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) Applied Research Systems ARS Holding N.V. (AN) 2004-07-28 EP disclosed
WO-2003037328-A1 OXINDOLE HYDRAZIDE MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2003-05-08 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 (2 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-20050043388-A1 Oxindole hydrazide modulators of protein tyrosine phosphatases (ptps) PTPRO, PTPRE, PTPRZ1 L3MBTL1 4356/4885GAA 2360/4885POLB 4789/4885
US-20100168101-A1 OXINDOLE HYDRAZIDE MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) PTPRO, PTPRE, PTPRZ1 L3MBTL1 4364/4885GAA 2377/4885POLB 4792/4885

“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.