SCHEMBL21533809

SCHEMBL21533809

C1=CCC(c2ccco2)=C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.40
ALDH1A1 P00352 5/20 0.40
POLB P06746 4/20 0.40
MAPT P10636 4/20 0.40
HSD17B10 Q99714 4/20 0.40
KMT2A Q03164 4/20 0.40
HPGD P15428 3/20 0.40
ALOX15 P16050 3/20 0.40
MEN1 O00255 3/20 0.40
BLM P54132 3/20 0.40
PKM P14618 2/20 0.40
CASP1 P29466 2/20 0.40
PTPN7 P35236 2/20 0.40
RECQL P46063 2/20 0.40
CASP7 P55210 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
USP2 O75604 1/20 0.40

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
SCHEMBL1176634 0.80 ALDH1A1 (0.38) KDM4EALDH1A1POLBMAPTHSD17B10
SCHEMBL26545868 0.78 ALDH1A1 (0.33) KDM4EALDH1A1POLBMAPTHSD17B10
SCHEMBL9770023 0.73 KDM4E (0.35) KDM4EALDH1A1POLBMAPTHSD17B10
SCHEMBL22750936 0.71 HSD17B10 (0.67) KDM4EALDH1A1POLBMAPTHSD17B10
SCHEMBL2885259 0.71
SCHEMBL13638238 0.69 ALDH1A1 (0.39) KDM4EALDH1A1POLBMAPTHSD17B10
Benzene SCHEMBL27953403 0.69
SCHEMBL1406996 0.68 GABRA1 (0.38) HPGDBLML3MBTL1LMNATSHR
SCHEMBL315517 0.68
SCHEMBL1799678 0.68 ALDH1A1 (0.63) KDM4EALDH1A1POLBMAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230302142-A1 Cytotoxic Agents Pheon Therapeutics Ltd. (GB) 2023-09-28 US disclosed
US-20190355911-A1 ORGANIC MIXTURE, ORGANIC COMPOSITION, ORGANIC ELECTRONIC COMPONENT AND PREPARATION METHOD THEREFOR GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-11-21 US disclosed
US-20190330152-A1 FUSED RING COMPOUND, HIGH POLYMER, MIXTURE, COMPOSITION, AND ORGANIC ELECTRONIC COMPONENT GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-10-31 US disclosed
CN-101466810-B Adhesive composition, method for producing same, and adhesive body JSR CORP 2011-04-27 CN disclosed
CN-101466810-A Adhesive composition, method for producing same, and adhesive body JSR CORP (JP) 2009-06-24 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 (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-20190330152-A1 FUSED RING COMPOUND, HIGH POLYMER, MIXTURE, COMPOSITION, AND ORGANIC ELECTRONIC COMPONENT EED, OCIAD2, OCIAD1 KDM4E 1195/4885ALDH1A1 1299/4885POLB 1800/4885
US-20230302142-A1 Cytotoxic Agents ANXA11, ANXA5, HAX1 KDM4E 4140/4885ALDH1A1 3438/4885POLB 1962/4885

“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.