SCHEMBL22263292

SCHEMBL22263292

O=C(O)NCCCCCCNC(=O)c1cccc2sc(N3CCOCC3)nc12

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.50
GAA P10253 3/20 0.45
MAPK1 P28482 1/20 0.45
LMNA P02545 1/20 0.45
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 1/20 0.40

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
SCHEMBL22280261 0.91 SMN1; SMN2 (0.52) SMN1; SMN2GAAMAPK1LMNARAB9A
Hydrochloric Acid SCHEMBL22263331 0.90 SMN1; SMN2 (0.51) SMN1; SMN2GAAMAPK1LMNARAB9A
SCHEMBL25943229 0.89 SMN1; SMN2 (0.49) SMN1; SMN2GAAMAPK1LMNARAB9A
SCHEMBL28663807 0.87 SMN1; SMN2 (0.45) SMN1; SMN2GAAMAPK1LMNARAB9A
SCHEMBL30617810 0.86 SMN1; SMN2 (0.44) SMN1; SMN2GAAMAPK1LMNAMAPT
SCHEMBL22280263 0.86 SMN1; SMN2 (0.44) SMN1; SMN2GAAMAPK1LMNAMAPT
SCHEMBL28655080 0.84 SMN1; SMN2 (0.42) SMN1; SMN2GAAMAPK1LMNARAB9A
SCHEMBL28655082 0.83 SMN1; SMN2 (0.42) SMN1; SMN2GAAMAPK1LMNARAB9A
SCHEMBL26459135 0.82 MAPK1 (0.41) SMN1; SMN2GAAMAPK1LMNARAB9A
SCHEMBL22263272 0.80 SMN1; SMN2 (0.64) SMN1; SMN2LMNARAB9ANPC1MAPT

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-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
US-20210292298-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR DBD THERAPEUTICS, LLC 2021-09-23 US 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 SMN1; SMN2 4546/4885GAA 3138/4885MAPK1 4357/4885
US-20200239430-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR AR, ADRM1, PSMA3 SMN1; SMN2 4554/4885GAA 3303/4885MAPK1 4388/4885
US-20240002360-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR AR, ADRM1, PSMA3 SMN1; SMN2 4554/4885GAA 3303/4885MAPK1 4388/4885
US-20210292298-A1 BI-FUNCTIONAL COMPOUNDS AND METHODS FOR TARGETED UBIQUITINATION OF ANDROGEN RECEPTOR AR, ADRM1, PSMA3 SMN1; SMN2 4554/4885GAA 3303/4885MAPK1 4388/4885

“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.