SCHEMBL5952980

SCHEMBL5952980

c1ccc(OB(Oc2ccccc2)c2cccc3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.41
ALDH1A1 P00352 7/20 0.37
HSD17B10 Q99714 5/20 0.37
TDP1 Q9NUW8 4/20 0.37
CYP2A6 P11509 3/20 0.37
TSHR P16473 3/20 0.37
HPGD P15428 4/20 0.35
CYP1A2 P05177 3/20 0.35
CYP3A4 P08684 3/20 0.35
KEAP1 Q14145 1/20 0.35
NR4A1 P22736 1/20 0.35
NR4A2 P43354 1/20 0.35
NR4A3 Q92570 1/20 0.35
HPRT1 P00492 1/20 0.34
MAPT P10636 2/20 0.34
ALOX15 P16050 2/20 0.34
KDM4E B2RXH2 2/20 0.34
TP53 P04637 1/20 0.34
CDC25B P30305 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL8624869 0.80 ALDH1A1 (0.43) KCNA3ALDH1A1HSD17B10TDP1HPGD
SCHEMBL14983513 0.78 CYP1A2 (0.42) ALDH1A1HSD17B10TDP1TSHRHPGD
SCHEMBL14983524 0.77 TRPM4 (0.39) KCNA3ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL30155141 0.75 ALDH1A1 (0.50) ALDH1A1HSD17B10TDP1CYP2A6TSHR
SCHEMBL1265002 0.75 ALDH1A1 (0.50) ALDH1A1HSD17B10TDP1CYP2A6TSHR
SCHEMBL5952337 0.75 ALDH1A1 (0.43) ALDH1A1HSD17B10TDP1CYP2A6TSHR
SCHEMBL25509448 0.75 ALDH1A1 (0.40) ALDH1A1HSD17B10TDP1CYP2A6TSHR
SCHEMBL1477784 0.72 ALDH1A1 (0.42) KCNA3ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL2409020 0.72 SIGMAR1 (0.35) KCNA3CYP1A2SLC6A4SIGMAR1
SCHEMBL5601623 0.71 CYP1A2 (0.39) ALDH1A1HSD17B10TDP1CYP2A6TSHR

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
US-8945820-B2 Silicon-containing resist underlayer film-forming composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-02-03 US disclosed
US-8945820-B2 Silicon-containing resist underlayer film-forming composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-02-03 US disclosed
US-20130137271-A1 SILICON-CONTAINING RESIST UNDERLAYER FILM-FORMING COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-05-30 US disclosed
US-20130137271-A1 SILICON-CONTAINING RESIST UNDERLAYER FILM-FORMING COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2013-05-30 US disclosed
US-7038070-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2006-05-02 US disclosed
US-6963017-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2005-11-08 US disclosed
EP-0968158-B1 METHOD OF PREPARING SUBSTITUTED INDANONES, THE SUBSTITUTED INDANONES AND METALLOCENES PREPARED THEREFROM BASELL POLYOLEFINE GMBH (DE) 2005-08-10 EP disclosed
US-20050033076-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2005-02-10 US disclosed
US-20030009046-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2003-01-09 US disclosed
EP-0968158-A1 METHOD OF PREPARING SUBSTITUTED INDANONES, THE SUBSTITUTED INDANONES AND METALLOCENES PREPARED THEREFROM Basell Polyolefine GmbH (DE) 2000-01-05 EP disclosed
WO-1998040331-A1 PREPARATION OF PREPARING SUBSTITUTED INDANONES TARGOR GMBH (DE) 1998-09-17 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 (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-20050033076-A1 Preparation of preparing substituted indanones CYP1A2, CYP2J2, IDH3A KCNA3 1187/4885ALDH1A1 317/4885HSD17B10 535/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 KCNA3 1125/4885ALDH1A1 198/4885HSD17B10 547/4885

“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.