SCHEMBL16335428

SCHEMBL16335428

CC(C)(O[Si](C)(C)C(C)(C)C)c1cc(Br)ccc1Cl

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ PTGDR2 Q9Y5Y4 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ NT5E P21589 1/20 0.30
▸ HPGD P15428 1/20 0.30

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
SCHEMBL16334881 0.77 IDO1 (0.38) POLBHPGD
SCHEMBL14992971 0.75 HTR2A (0.36) APLNRALDH1A1KDM4EPOLBMAPT
SCHEMBL1890897 0.73 ALDH1A1 (0.33) APLNRALDH1A1KDM4E
SCHEMBL12791524 0.73 PTGDR2 (0.42) ALDH1A1PTGDR2KDM4EPOLBMAPT
SCHEMBL932790 0.71 TSHR (0.40) APLNRALDH1A1KDM4EMAPTHPGD
SCHEMBL16335644 0.71 IDO1 (0.39) ALDH1A1PTGDR2MAPT
SCHEMBL195484 0.70 SLC6A4 (0.36) APLNRHTTHPGD
SCHEMBL3234438 0.70 ALDH1A1 (0.42) ALDH1A1PTGDR2KDM4EPOLBMAPT
SCHEMBL31342658 0.70 NT5E (0.40) ALDH1A1PTGDR2MAPTNT5E
SCHEMBL5779231 0.70 NT5E (0.40) ALDH1A1PTGDR2MAPTNT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160145202-A1 Strobilurin Type Compounds for Combating Phytopathogenic Fungi BASF SE (DE) 2016-05-26 — — US disclosed
EP-3013794-A1 STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2016-05-04 — — EP disclosed
WO-2014207071-A1 STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI BASF SE (DE) 2014-12-31 — — 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-20160145202-A1 Strobilurin Type Compounds for Combating Phytopathogenic Fungi DPM1, CROCC, SNX1 APLNR 2827/4885ALDH1A1 3309/4885PTGDR2 4831/4885

“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.

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