SCHEMBL4459810

SCHEMBL4459810

O=C1CC(Sc2ccccc2)C(=O)O1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
F2 P00734 2/20 0.41
PRSS1 P07477 2/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CTRC Q99895 1/20 0.37
CTRB1 P17538 1/20 0.36
ALDH1A1 P00352 4/20 0.34
HPGD P15428 2/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
ALDH2 P05091 1/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GRM6 O15303 2/20 0.31
GRM2 Q14416 2/20 0.31
GRM3 Q14832 2/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL11754494 0.82 DDB1 (0.47) DDB1CRBNMEN1KMT2AALDH1A1
SCHEMBL11220100 0.82 CRBN (0.47) DDB1CRBNMEN1KMT2AALDH1A1
SCHEMBL10960844 0.82 NR1H2 (0.34) DDB1CRBNMEN1KMT2AALDH1A1
SCHEMBL19463659 0.82 DDB1 (0.51) DDB1CRBNALDH1A1HPGDGAA
SCHEMBL11756918 0.80 DDB1 (0.51) DDB1CRBNMEN1KMT2AALDH1A1
SCHEMBL11757714 0.80 DDB1 (0.51) DDB1CRBNMEN1KMT2AALDH1A1
SCHEMBL11754928 0.77 NR3C1 (0.40) CRBNMEN1KMT2AALDH1A1POLB
SCHEMBL11755863 0.76 LDHA (0.38) MAPT
SCHEMBL10961455 0.76 DDB1 (0.49) DDB1CRBNMEN1KMT2AALDH1A1
SCHEMBL11757038 0.76 ALDH1A1 (0.36) MEN1KMT2AALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2997046-B1 CELLULOSE ETHERS ESTERIFIED WITH DICARBOXYLIC ACIDS DOW GLOBAL TECHNOLOGIES LLC (US) 2019-09-25 EP disclosed
US-9890221-B2 Cellulose ethers esterified with dicarboxylic acid DOW GLOBAL TECHNOLOGIES LLC (US) 2018-02-13 US disclosed
US-20160289344-A1 CELLULOSE ETHERS ESTERIFIED WITH DICARBOXYLIC ACID REGENTS OF THE UNIVERSITY OF MINNESOTA 2016-10-06 US disclosed
EP-2997046-A1 CELLULOSE ETHERS ESTERIFIED WITH DICARBOXYLIC ACIDS Dow Global Technologies LLC (US) 2016-03-23 EP disclosed
WO-2014186185-A1 CELLULOSE ETHERS ESTERIFIED WITH DICARBOXYLIC ACIDS DOW GLOBAL TECHNOLOGIES LLC (US) 2014-11-20 WO disclosed
EP-1991526-B1 Tetracyclic indole derivatives as in vivo imaging agents and having peripheralbenzodiazepine receptor affinity (PBR) HAMMERSMITH IMANET LTD (GB) 2014-02-12 EP disclosed
US-8506932-B2 Tetracyclic indole derivatives as in vivo imaging agents and having peripheralbenzodiazepine receptor affinity (PBR) HAMMERSMITH IMANET LIMITED (GB) 2013-08-13 US disclosed
US-20090220420-A1 TETRACYCLIC INDOLE DERIVATIVES AS IN VIVO IMAGING AGENTS AND HAVING PERIPHERALBENZODIAZEPINE RECEPTOR AFFINITY (PBR) GE HEALTHCARE LIMITED (GB) 2009-09-03 US disclosed
EP-1991526-A1 TETRACYCLIC INDOLE DERIVATIVES AS IN VIVO IMAGING AGENTS AND HAVING PERIPHERALBENZODIAZEPINE RECEPTOR AFFINITY (PBR) Hammersmith Imanet, Ltd (GB) 2008-11-19 EP disclosed
WO-2007057705-A1 TETRACYCLIC INDOLE DERIVATIVES AS IN VIVO IMAGING AGENTS AND HAVING PERIPHERALBENZODIAZEPINE RECEPTOR AFFINITY (PBR) HAMMERSMITH IMANET LIMITED (GB) 2007-05-24 WO disclosed
US-4009278-A Antimicrobial composition and method containing N-(3,5-dihalophenyl)-imide compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-02-22 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-20160289344-A1 CELLULOSE ETHERS ESTERIFIED WITH DICARBOXYLIC ACID SCO2, SUCNR1, MCCC2 DDB1 2899/4885CRBN 1087/4885F2 1279/4885
US-20090220420-A1 TETRACYCLIC INDOLE DERIVATIVES AS IN VIVO IMAGING AGENTS AND HAVING PERIPHERALBENZODIAZEPINE RECEPTOR AFFINITY (PBR) KIT, CNR1, CNR2 DDB1 2638/4885CRBN 569/4885F2 3692/4885

“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.