SCHEMBL4496440

SCHEMBL4496440

COC(=O)c1cccc(C(=O)O)c1OC

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 4/20 0.51
TSHR P16473 2/20 0.50
LMNA P02545 1/20 0.50
ALDH1A1 P00352 4/20 0.48
HSD17B10 Q99714 3/20 0.48
CFTR P13569 1/20 0.48
KDM4E B2RXH2 5/20 0.47
HPGD P15428 3/20 0.47
MAPT P10636 2/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
POLB P06746 1/20 0.47
ATM Q13315 1/20 0.47
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
SLC6A3 Q01959 1/20 0.46
CASR P41180 1/20 0.46
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL3511611 0.92 TSHR (0.57) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL39857 0.90 ALDH1A1 (0.55) APEX1TSHRALDH1A1HSD17B10KDM4E
SCHEMBL6852883 0.88 MAPT (0.52) TSHRLMNAALDH1A1HSD17B10CFTR
Hydrochloric Acid SCHEMBL699717 0.88 ALDH1A1 (0.53) APEX1TSHRLMNAALDH1A1HSD17B10
SCHEMBL11046315 0.86 MAPT (0.50) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL27392559 0.86 HSD17B10 (0.47) APEX1TSHRLMNAALDH1A1HSD17B10
SCHEMBL8078670 0.85 ALDH1A1 (0.50) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL23092927 0.85 LMNA (0.50) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL27673639 0.84 HSD17B10 (0.65) TSHRLMNAALDH1A1HSD17B10CFTR
SCHEMBL18537273 0.83 TSHR (0.53) TSHRLMNAALDH1A1HSD17B10CFTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210253950-A1 ULTRABRIGHT LUMINESCENT LANTHANIDE NANOPARTICLES COMPRISING TERBIUM, WITH LONGER EXCITED-STATE LIFETIME UNIVERSITE PARIS SACLAY (FR) 2021-08-19 US disclosed
WO-2021050688-A1 COMPOUNDS AND USES THEREOF X-CHEM, INC. (US) 2021-03-18 WO disclosed
WO-2021050688-A1 COMPOUNDS AND USES THEREOF X-CHEM, INC. (US) 2021-03-18 WO 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
CN-1318403-C Indoline derivatives substituted in the 6 position, their preparation and their use as medicaments BOEHRINGER INGELHEIM PHARMA (DE) 2007-05-30 CN disclosed
US-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-08-31 US disclosed
CN-1668589-A Indoline derivatives substituted in the 6-position, their preparation and their use as medicaments BOEHRINGER INGELHEIM PHARMA (DE) 2005-09-14 CN 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-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions KDR, FLT1, EGFR APEX1 3711/4885TSHR 503/4885LMNA 1884/4885

“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.