SCHEMBL26458197

SCHEMBL26458197

NCCCOc1c(-c2csc(N3CCOCC3)n2)ccc(F)c1F

nearest known ligand 0.75

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 16/20 0.75
▸ NPC1 O15118 4/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ MAPK1 P28482 3/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ GAA P10253 1/20 0.43

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
Hydrochloric Acid SCHEMBL30219487 0.99 AR (0.74) ARNPC1RAB9ASMN1; SMN2MAPK1
SCHEMBL25942722 0.92 AR (0.78) ARNPC1RAB9ASMN1; SMN2MAPK1
SCHEMBL25942616 0.91 AR (0.71) ARNPC1RAB9ASMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL22263280 0.90 AR (0.70) ARNPC1RAB9ASMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL22263323 0.90 AR (0.70) ARNPC1RAB9ASMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL30219483 0.90 AR (0.70) ARNPC1RAB9ASMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL22263265 0.90 AR (0.70) ARNPC1RAB9ASMN1; SMN2MAPK1
SCHEMBL26459201 0.88 AR (0.67) ARNPC1RAB9ASMN1; SMN2MAPK1
SCHEMBL27411371 0.87 AR (0.71) ARNPC1RAB9ASMN1; SMN2MAPK1
SCHEMBL26458261 0.86 AR (0.67) ARNPC1RAB9ASMN1; SMN2MAPK1

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-20230132823-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR DBD THERAPEUTICS, LLC 2023-05-04 — — US disclosed
US-20230132823-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR DBD THERAPEUTICS, LLC 2023-05-04 — — 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-20230132823-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR AR, ADRM1, PSMA3 AR 1/4885NPC1 3776/4885RAB9A 3327/4885

“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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