SCHEMBL3217675

SCHEMBL3217675

NC(=O)CCCCCc1ccco1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
HPGD P15428 3/20 0.53
TDP1 Q9NUW8 2/20 0.53
CYP3A4 P08684 1/20 0.53
ALOX15 P16050 1/20 0.53
USP2 O75604 1/20 0.53
ALOX5 P09917 1/20 0.49
EPHX2 P34913 3/20 0.45
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
PTPN7 P35236 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
GLS O94925 1/20 0.40
CHRM2 P08172 1/20 0.40
TBXAS1 P24557 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL11234382 0.98 ALDH1A1 (0.50) ALDH1A1HPGDTDP1CYP3A4ALOX15
SCHEMBL2100645 0.93 ALOX5 (0.51) ALDH1A1HPGDTDP1CYP3A4ALOX15
SCHEMBL4373147 0.87 ALDH1A1 (0.54) ALDH1A1HPGDTDP1CYP3A4ALOX15
SCHEMBL5634683 0.87 ALDH1A1 (0.54) ALDH1A1HPGDTDP1CYP3A4ALOX15
SCHEMBL4369185 0.87 ALDH1A1 (0.54) ALDH1A1HPGDTDP1CYP3A4ALOX15
SCHEMBL4382935 0.87 ALDH1A1 (0.54) ALDH1A1HPGDTDP1CYP3A4ALOX15
SCHEMBL4379184 0.87 ALDH1A1 (0.54) ALDH1A1HPGDTDP1CYP3A4ALOX15
SCHEMBL1326250 0.87 ALOX5 (0.53) ALDH1A1HPGDTDP1CYP3A4ALOX15
SCHEMBL8091454 0.86 MAPT (0.55) ALDH1A1HPGDTDP1CYP3A4ALOX15
SCHEMBL11722021 0.86 MAPT (0.55) ALDH1A1HPGDTDP1CYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100041694-A1 AGRICULTURAL COMPOSITION FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENIC MICROBES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-02-18 US disclosed
WO-2008126684-A2 AGRICULTURAL COMPOSITION FOR CONTROLLING OR PREVENTING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-10-23 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 (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-20100041694-A1 AGRICULTURAL COMPOSITION FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENIC MICROBES HDHD5, NAAA, BROX ALDH1A1 3801/4885HPGD 1430/4885TDP1 3566/4885

“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.