SCHEMBL7846695

SCHEMBL7846695

CC(C)(C)c1cccc(CNC(=O)c2cccnc2)c1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.69
ALDH1A1 P00352 2/20 0.69
MAPT P10636 1/20 0.69
HTT P42858 1/20 0.69
NPC1 O15118 3/20 0.67
KMT2A Q03164 4/20 0.61
MEN1 O00255 3/20 0.61
RAB9A P51151 4/20 0.60
L3MBTL1 Q9Y468 1/20 0.59
NR1H4 Q96RI1 1/20 0.58
NAMPT P43490 1/20 0.58
TSHR P16473 2/20 0.57
HPGD P15428 2/20 0.56
SMN1; SMN2 Q16637 3/20 0.55
GAA P10253 2/20 0.55
ALOX12 P18054 1/20 0.55
THRB P10828 1/20 0.52

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
SCHEMBL14005562 0.90 ALDH1A1 (0.77) LMNAALDH1A1MAPTHTTNPC1
SCHEMBL8376717 0.86 NPC1 (0.72) LMNAALDH1A1MAPTHTTNPC1
SCHEMBL7845272 0.86 LMNA (0.62) LMNAALDH1A1MAPTHTTKMT2A
SCHEMBL7844235 0.86 LMNA (0.78) LMNAALDH1A1MAPTHTTNPC1
SCHEMBL12993425 0.84 NR1H4 (0.75) LMNAALDH1A1MAPTHTTNPC1
SCHEMBL14724809 0.83 NPC1 (0.72) LMNAALDH1A1MAPTHTTNPC1
SCHEMBL13483867 0.82 LMNA (1.00) LMNAALDH1A1MAPTHTTKMT2A
SCHEMBL7082686 0.81 TSHR (0.73) LMNAALDH1A1MAPTHTTNPC1
SCHEMBL12042433 0.81 ALDH1A1 (0.60) LMNAALDH1A1MAPTHTTRAB9A
SCHEMBL27846421 0.81 NPC1 (0.72) LMNAALDH1A1MAPTHTTNPC1

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-8377945-B2 Small molecule inhibitors of spleen tyrosine kinase (SYK) RIGEL PHARMACEUTICALS INC. (US) 2013-02-19 US disclosed
US-7858616-B2 Indolinone derivatives substituted in the 6 position, their preparation and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2010-12-28 US disclosed
US-20100316649-A1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) MIDCAP FINANCIAL TRUST 2010-12-16 US disclosed
US-20090197876-A1 INDOLINONE DERIVATIVES SUBSTITUTED IN THE 6 POSITION, THEIR PREPARATION AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-08-06 US disclosed
US-7547703-B2 Indoline derivatives substituted in the 6-position, their preparation and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-06-16 US disclosed
US-7514468-B2 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-04-07 US disclosed
US-7169936-B2 Indolinone derivatives substituted in the 6-position, their preparation and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2007-01-30 US disclosed
US-20070004757-A1 INDOLINE DERIVATIVES SUBSTITUTED IN THE 6 POSITION, THEIR PREPARATION AND THEIR USE AS MEDICAMENTS ROTH GERALD J 2007-01-04 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 (3 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-20070004757-A1 INDOLINE DERIVATIVES SUBSTITUTED IN THE 6 POSITION, THEIR PREPARATION AND THEIR USE AS MEDICAMENTS KDR, FLT1, EGFR LMNA 2104/4885ALDH1A1 3469/4885MAPT 882/4885
US-20100316649-A1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) SYK, BTK, LCK LMNA 4328/4885ALDH1A1 4307/4885MAPT 4045/4885
US-20090197876-A1 INDOLINONE DERIVATIVES SUBSTITUTED IN THE 6 POSITION, THEIR PREPARATION AND THEIR USE AS MEDICAMENTS KDR, FLT1, ERBB2 LMNA 1886/4885ALDH1A1 2738/4885MAPT 1019/4885

“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.