SCHEMBL6345112

SCHEMBL6345112

NC(=O)CCNC(=O)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.66
HPGD P15428 3/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
L3MBTL1 Q9Y468 2/20 0.64
LMNA P02545 2/20 0.64
POLB P06746 2/20 0.62
HDAC1 Q13547 2/20 0.60
HDAC3 O15379 1/20 0.60
TSHR P16473 1/20 0.59
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
ATM Q13315 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
THRA P10827 1/20 0.53

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
SCHEMBL11112888 0.87 ALDH1A1 (0.71) ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA
SCHEMBL8298064 0.86 TSHR (0.62) ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA
SCHEMBL11152019 0.85 HDAC1 (0.71) ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA
SCHEMBL6835143 0.84 ALDH1A1 (0.71) ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA
SCHEMBL9492603 0.84 ALDH1A1 (0.76) ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA
SCHEMBL656530 0.83 ALDH1A1 (0.71) ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA
SCHEMBL5149346 0.82 ALDH1A1 (0.69) ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA
SCHEMBL8298069 0.82 ALDH1A1 (0.70) ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA
SCHEMBL10604299 0.81 ALDH1A1 (0.66) ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA
SCHEMBL5507075 0.81 ALDH1A1 (0.70) ALDH1A1HPGDSMN1; SMN2L3MBTL1LMNA

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-6858641-B2 Substituted indolinones BOEHRINGER INGELHEIM PHARMA KG (DE) 2005-02-22 US disclosed
CN-1509270-A Indolinones substituted in the 6-position, process for their preparation and their use as kinase inhibitors ���ָ��Ӣ��ķ�������Ϲ�˾ 2004-06-30 CN disclosed
EP-1379501-A1 INDOLINONES, SUBSTITUTED IN POSITION 6, AND THEIR USE AS KINASE INHIBITORS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2004-01-14 EP disclosed
US-20030092756-A1 Substituted indolinones BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-05-15 US disclosed
WO-2002081445-A1 INDOLINONES, SUBSTITUTED IN POSITION 6, AND THEIR USE AS KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-10-17 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-20030092756-A1 Substituted indolinones CDK1, CDK2, CDKL1 ALDH1A1 1526/4885HPGD 1513/4885SMN1; SMN2 4355/4885

“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.