SCHEMBL1149294

SCHEMBL1149294

COC(=O)C(NC(=O)O)C(c1ccc(O)c(O)c1)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 9/20 0.43
BLM P54132 5/20 0.43
LMNA P02545 4/20 0.43
NR1I2 O75469 1/20 0.43
PTGS1 P23219 1/20 0.43
ADRA1A P35348 1/20 0.43
KDM4E B2RXH2 7/20 0.38
MAPT P10636 6/20 0.38
HSD17B10 Q99714 4/20 0.38
TSHR P16473 3/20 0.38
NFKB1 P19838 3/20 0.38
HIF1A Q16665 3/20 0.38
CYP1A2 P05177 2/20 0.38
ADRB2 P07550 2/20 0.38
GAA P10253 2/20 0.38
RXFP1 Q9HBX9 2/20 0.38
THPO P40225 2/20 0.38
SLC6A2 P23975 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38

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
SCHEMBL1673397 0.84 ESR1 (0.44) TSHRTAS1R3TAS1R1SMN1; SMN2CA12
SCHEMBL1149486 0.84 APP (0.42) TDP1BLMLMNANR1I2PTGS1
SCHEMBL7272826 0.74 TDP1 (0.47) TDP1BLMLMNANR1I2PTGS1
SCHEMBL9335039 0.74 TDP1 (0.47) TDP1BLMLMNANR1I2PTGS1
SCHEMBL5281995 0.71 BLM (0.51) TDP1BLMLMNANR1I2PTGS1
SCHEMBL13176797 0.71 MT-CO2 (0.59) TDP1BLMLMNAPTGS1ADRA1A
SCHEMBL5092494 0.71 BLM (0.51) TDP1BLMLMNANR1I2PTGS1
SCHEMBL13400917 0.69 TDP1 (0.49) TDP1BLMLMNANR1I2PTGS1
SCHEMBL10756563 0.69 TDP1 (0.66) TDP1BLMLMNANR1I2PTGS1
SCHEMBL19565604 0.69 TDP1 (0.66) TDP1BLMLMNANR1I2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8722923-B2 Conjugates for treating neurodegenerative diseases and disorders RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2014-05-13 US disclosed
US-20120277310-A1 NOVEL CONJUGATES FOR TREATING NEURODEGENERATIVE DISEASES AND DISORDERS BAR-ILAN UNIVERSITY (IL) 2012-11-01 US disclosed
US-8207369-B2 Conjugates for treating neurodegenerative diseases and disorders RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2012-06-26 US disclosed
US-20110034553-A1 NOVEL CONJUGATES FOR TREATING NEURODEGENERATIVE DISEASES AND DISORDERS RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2011-02-10 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 (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-20120277310-A1 NOVEL CONJUGATES FOR TREATING NEURODEGENERATIVE DISEASES AND DISORDERS SLC18A2, GABRB2, SLC6A13 TDP1 328/4885BLM 4102/4885LMNA 4009/4885
US-20110034553-A1 NOVEL CONJUGATES FOR TREATING NEURODEGENERATIVE DISEASES AND DISORDERS SLC18A2, SNCA, SLC6A13 TDP1 262/4885BLM 4104/4885LMNA 4023/4885

“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.