SCHEMBL9891700

SCHEMBL9891700

OC(c1ccc(Br)cc1)C1CCCCO1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 8/20 0.40
POLB P06746 1/20 0.38
ALDH1A1 P00352 2/20 0.35
SLC18A3 Q16572 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL1128830 0.83 SLC6A3 (0.45) SLC6A3ALDH1A1HPGDSMN1; SMN2
SCHEMBL31618596 0.83 SLC6A3 (0.56) SLC6A3HPGD
SCHEMBL1237578 0.78 POLB (0.42) SLC6A3POLBALDH1A1
SCHEMBL11348436 0.77 SLC6A3 (0.50) SLC6A3HPGDSMN1; SMN2
SCHEMBL14949943 0.76 SLC18A3 (0.39) SLC6A3ALDH1A1SLC18A3HPGDSMN1; SMN2
SCHEMBL7375852 0.73 HSD17B3 (0.42) SLC6A3ALDH1A1HPGDSMN1; SMN2
SCHEMBL10562369 0.73 USP5 (0.48) SLC6A3ALDH1A1SMN1; SMN2
SCHEMBL5238474 0.73 DHODH (0.54) POLBSLC18A3SMN1; SMN2
SCHEMBL21363516 0.72 RAB9A (0.38) SLC6A3ALDH1A1HPGDSMN1; SMN2
SCHEMBL28416578 0.71 ALDH1A1 (0.34) SLC6A3POLBALDH1A1SLC18A3HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8912348-B2 Tetrahydropyranyl compound and method for producing the tetrahydropyranyl compound RICOH COMPANY, LTD. (JP) 2014-12-16 US disclosed
WO-2012099181-A1 ELECTROPHOTOGRAPHIC PHOTOCONDUCTOR, IMAGE FORMING METHOD, IMAGE FORMING APPARATUS, AND PROCESS CARTRIDGE RICOH COMPANY, LTD. (JP) 2012-07-26 WO disclosed
US-20120142948-A1 TETRAHYDROPYRANYL COMPOUND AND METHOD FOR PRODUCING THE TETRAHYDROPYRANYL COMPOUND RICOH COMPANY, LTD. (JP) 2012-06-07 US disclosed
US-20120142948-A1 TETRAHYDROPYRANYL COMPOUND AND METHOD FOR PRODUCING THE TETRAHYDROPYRANYL COMPOUND RICOH COMPANY, LTD. (JP) 2012-06-07 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 (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-20120142948-A1 TETRAHYDROPYRANYL COMPOUND AND METHOD FOR PRODUCING THE TETRAHYDROPYRANYL COMPOUND CYP4A11, CYP11B1, CYP11B2 SLC6A3 4432/4885POLB 3032/4885ALDH1A1 2275/4885

“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.