SCHEMBL23122910

SCHEMBL23122910

O=C(c1cccc(-n2ccc(=O)[nH]c2=O)c1)N1CCC(O[C@@H]2CCN(Cc3ccc(Br)cc3)C[C@H]2F)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CXCR3 P49682 3/20 0.41
▸ GAA P10253 2/20 0.41
▸ OPRM1 P35372 3/20 0.37
▸ KMT2A Q03164 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ USP2 O75604 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CCR2 P41597 1/20 0.36

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
SCHEMBL23122908 0.84 CXCR3 (0.48) CXCR3GAAKMT2A
SCHEMBL23123672 0.83 GAA (0.34) GAAKMT2AMAPTUSP2ALDH1A1
SCHEMBL23121719 0.79 HSD11B1 (0.38) —
Hydrochloric Acid SCHEMBL23121759 0.78 BCL9 (0.38) —
SCHEMBL23121671 0.75 HSD11B1 (0.43) —
Hydrochloric Acid SCHEMBL23122764 0.74 HSD11B1 (0.42) —
SCHEMBL23133980 0.71 DDB1 (0.38) CXCR3GAAALDH1A1TSHR
SCHEMBL23122012 0.67 BCL9 (0.37) TSHR
SCHEMBL23123241 0.67 DDB1 (0.40) KMT2AMAPTUSP2ALDH1A1LMNA
SCHEMBL23120510 0.62 BCL9 (0.40) TSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220315578-A1 BRD9 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2022-10-06 — — US disclosed
CN-114641473-A BRD9 bifunctional degradation agent and use method thereof 诺华股份有限公司 2022-06-17 — — CN disclosed
WO-2021055295-A1 BRD9 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE NOVARTIS AG (CH) 2021-03-25 — — 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-20220315578-A1 BRD9 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE BRD9, BRD2, BRD1 CXCR3 3721/4885GAA 1240/4885OPRM1 3951/4885

“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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