SCHEMBL2836025

SCHEMBL2836025

CCOC(=O)c1ccc(NC(=O)c2ccc(C#N)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.70
RAB9A P51151 8/20 0.70
NPC1 O15118 4/20 0.70
GAA P10253 3/20 0.70
ALDH1A1 P00352 4/20 0.60
KDM4E B2RXH2 3/20 0.60
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
MLYCD O95822 1/20 0.57
TSHR P16473 3/20 0.56
MAPT P10636 4/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
CASP3 P42574 1/20 0.55
TRPV1 Q8NER1 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
TP53 P04637 1/20 0.55
POLB P06746 1/20 0.55
ALOX15 P16050 1/20 0.54
LMNA P02545 1/20 0.54
MAPK1 P28482 1/20 0.54

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
SCHEMBL5879030 0.88 RAB9A (0.88) SMN1; SMN2RAB9ANPC1GAAALDH1A1
SCHEMBL10943445 0.88 RAB9A (0.88) SMN1; SMN2RAB9ANPC1GAAALDH1A1
SCHEMBL5472654 0.87 RAF1 (0.59) SMN1; SMN2RAB9ANPC1GAAALDH1A1
SCHEMBL1365179 0.87 CA12 (0.61) SMN1; SMN2GAAALDH1A1KDM4EKMT2A
SCHEMBL28306812 0.87 CA12 (0.61) SMN1; SMN2GAAALDH1A1KDM4EKMT2A
SCHEMBL29649031 0.86 SMN1; SMN2 (0.56) SMN1; SMN2RAB9ANPC1GAAALDH1A1
SCHEMBL2833360 0.85 NPC1 (0.65) SMN1; SMN2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL31311144 0.85 NPC1 (0.65) SMN1; SMN2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL9337665 0.83 MLYCD (0.76) RAB9ANPC1KDM4EMEN1KMT2A
SCHEMBL6263516 0.83 MLYCD (0.76) RAB9ANPC1KDM4EMEN1KMT2A

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 8 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
EP-0346713-B1 BENZAMIDINES USEFUL AS ULTRAVIOLET LIGHT ABSORBERS L. GIVAUDAN & CIE Société Anonyme (CH) 1992-09-16 EP disclosed
US-5011628-A N,N'-diarylbenzamidines useful as ultraviolet light absorbers GIVAUDAN CORPORATION (US) 1991-04-30 US disclosed
EP-0346713-A1 Benzamidines useful as ultraviolet light absorbers L. GIVAUDAN & CIE Société Anonyme (CH) 1989-12-20 EP 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 SMN1; SMN2 4885/4885RAB9A 3219/4885NPC1 1600/4885
US-20100168101-A1 OXINDOLE HYDRAZIDE MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) PTPRO, PTPRE, PTPRZ1 SMN1; SMN2 4885/4885RAB9A 3161/4885NPC1 1625/4885

“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.