SCHEMBL26600712

SCHEMBL26600712

N#Cc1cc(Br)cnc1OC1CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACACB O00763 6/20 0.41
TBK1 Q9UHD2 1/20 0.36
IP6K1 Q92551 2/20 0.34
MALT1 Q9UDY8 1/20 0.34
CHEK1 O14757 1/20 0.34
CHRNB2 P17787 5/20 0.33
CHRNB4 P30926 5/20 0.33
CHRNA3 P32297 5/20 0.33
CHRNA4 P43681 5/20 0.33
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
JAK2 O60674 1/20 0.31
CHRM4 P08173 1/20 0.31

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
SCHEMBL14976692 0.90 TBK1 (0.46) TBK1
SCHEMBL31402961 0.90 IKBKB (0.40) ACACBTBK1IP6K1CHEK1CHRNB2
SCHEMBL31403060 0.82 RORC (0.40) ACACBTBK1HPGDJAK2
SCHEMBL29818537 0.81 ACACB (0.41) ACACBTBK1IP6K1MALT1CHRM4
SCHEMBL20265237 0.81 ACACB (0.41) ACACBTBK1IP6K1MALT1CHRM4
SCHEMBL323094 0.76 GAA (0.40) CHEK1MEN1POLBHPGDKMT2A
SCHEMBL31294273 0.76 GAA (0.40) CHEK1MEN1POLBHPGDKMT2A
SCHEMBL22906900 0.76 CTSL (0.40) ACACB
SCHEMBL22906969 0.76 CTSL (0.40) ACACB
SCHEMBL29547503 0.76 CTSL (0.40) ACACB

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-20230373934-A1 ANDROGEN RECEPTOR MODULATORS AND METHODS FOR THEIR USE ESSA PHARMA INC. (CA) 2023-11-23 US disclosed
US-20230373934-A1 ANDROGEN RECEPTOR MODULATORS AND METHODS FOR THEIR USE ESSA PHARMA INC. (CA) 2023-11-23 US disclosed
US-20230373934-A1 ANDROGEN RECEPTOR MODULATORS AND METHODS FOR THEIR USE ESSA PHARMA INC. (CA) 2023-11-23 US disclosed
WO-2023205507-A1 ANDROGEN RECEPTOR MODULATORS AND METHODS FOR THEIR USE ESSA PHARMA INC. (CA) 2023-10-26 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-20230373934-A1 ANDROGEN RECEPTOR MODULATORS AND METHODS FOR THEIR USE AR, SHBG, NR5A1 ACACB 922/4885TBK1 4416/4885IP6K1 2580/4885

“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.