SCHEMBL22263271

SCHEMBL22263271

O=C(O)NCCCCNC(=O)COc1c(-c2csc(N3CCOCC3)n2)ccc(F)c1F

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 14/20 0.61
▸ VHL P40337 1/20 0.53
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ RAF1 P04049 1/20 0.38
▸ BRAF P15056 1/20 0.38

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
SCHEMBL22263332 0.99 AR (0.60) ARVHLNPC1RAB9AALDH1A1
SCHEMBL22402900 0.94 AR (0.59) ARVHLNPC1RAB9AALDH1A1
Hydrochloric Acid SCHEMBL22263254 0.93 AR (0.60) ARVHLNPC1RAB9AALDH1A1
SCHEMBL23846235 0.92 AR (0.61) ARVHLNPC1RAB9ALMNA
Hydrochloric Acid SCHEMBL30938119 0.92 AR (0.59) ARVHLNPC1RAB9AALDH1A1
Hydrochloric Acid SCHEMBL30938120 0.92 AR (0.59) ARVHLNPC1RAB9AALDH1A1
Hydrochloric Acid SCHEMBL22263225 0.92 AR (0.59) ARVHLNPC1RAB9AALDH1A1
SCHEMBL27412012 0.90 AR (0.66) ARVHLNPC1RAB9ALMNA
SCHEMBL28654521 0.90 AR (0.56) ARVHLNPC1RAB9AALDH1A1
SCHEMBL28650197 0.89 AR (0.58) ARVHLNPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240002360-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR DBD THERAPEUTICS, LLC 2024-01-04 — — US disclosed
US-11787778-B2 Bi-functional compounds and methods for targeted ubiquitination of androgen receptor MONTELINO THERAPEUTICS, INC. (US) 2023-10-17 — — US disclosed
WO-2023039603-A2 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR MONTELINO THERAPEUTICS, INC. (US) 2023-03-16 — — WO disclosed
EP-3917916-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR Montelino Therapeutics, Inc. (US) 2021-12-08 — — EP disclosed
US-20210292298-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR DBD THERAPEUTICS, LLC 2021-09-23 — — US disclosed
WO-2020160295-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR MONTELINO THERAPEUTICS, LLC (US) 2020-08-06 — — WO disclosed
US-20200239430-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR MONTELINO THERAPEUTICS, LLC (US) 2020-07-30 — — 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 (4 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-11787778-B2 Bi-functional compounds and methods for targeted ubiquitination of androgen receptor AR, ADRM1, PSMA3 AR 1/4885VHL 525/4885NPC1 3776/4885
US-20200239430-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR AR, ADRM1, PSMA3 AR 1/4885VHL 491/4885NPC1 3994/4885
US-20240002360-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR AR, ADRM1, PSMA3 AR 1/4885VHL 491/4885NPC1 3994/4885
US-20210292298-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR AR, ADRM1, PSMA3 AR 1/4885VHL 491/4885NPC1 3994/4885

“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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