SCHEMBL18539752

SCHEMBL18539752

CP(C)(=O)c1ccc(CN)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.46
LOXL2 Q9Y4K0 6/20 0.44
PSIP1 O75475 1/20 0.43
ABAT P80404 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA12 O43570 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
MAPT P10636 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
NOS3 P29474 2/20 0.39

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
SCHEMBL12441767 0.78 SMN1; SMN2 (0.48) CA2TAAR1SMN1; SMN2
SCHEMBL2208306 0.76 TSHR (0.40) CA1CA2CA12CA4CA6
SCHEMBL13538144 0.76 CA2 (0.48) HRH3LOXL2ABATHDAC3HDAC6
Hydrochloric Acid SCHEMBL22165294 0.74 CA2 (0.46) HRH3LOXL2ABATHDAC3HDAC6
SCHEMBL28858779 0.74 PSIP1 (0.42) HRH3LOXL2PSIP1ABATHDAC3
SCHEMBL23031966 0.73 ESR1 (0.50) TAAR1
SCHEMBL18550519 0.73 LOXL2 (0.47) LOXL2HDAC6MAPTNOS3NOS1
SCHEMBL31019757 0.73 LOXL2 (0.39) HRH3LOXL2PSIP1ABATHDAC3
SCHEMBL15828 0.72 HRH3 (0.79) HRH3LOXL2PSIP1ABATCA1
SCHEMBL1491759 0.72 MEN1 (0.44) CA1CA2CA12CA4CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023226950-A1 PEPTIDOMIMETIC STAT PROTEIN DEGRADER, COMPOSITION AND USE THEREOF 杭州和正医药有限公司 2023-11-30 WO disclosed
CN-117126231-A Peptoid STAT protein degradation agent, composition and application thereof 杭州和正医药有限公司 2023-11-28 CN disclosed
EP-3298022-B1 NOVEL ANNELATED PHENOXYACETAMIDES BOEHRINGER INGELHEIM INT (DE) 2019-06-05 EP disclosed
US-10221202-B2 Annelated phenoxyacetamides BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2019-03-05 US disclosed
US-20170313732-A1 NOVEL ANNELATED PHENOXYACETAMIDES BOEHRINGER INGELHEIM INT (DE) 2017-11-02 US disclosed
US-20170313732-A1 NOVEL ANNELATED PHENOXYACETAMIDES BOEHRINGER INGELHEIM INT (DE) 2017-11-02 US disclosed
WO-2017028927-A1 NOVEL ANNELATED PHENOXYACETAMIDES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-02-23 WO disclosed
US-20170050992-A1 NOVEL ANNELATED PHENOXYACETAMIDES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-02-23 US disclosed
US-20170050992-A1 NOVEL ANNELATED PHENOXYACETAMIDES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-02-23 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 (3 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-20170313732-A1 NOVEL ANNELATED PHENOXYACETAMIDES EP300, NAT1, AADAC HRH3 118/4885LOXL2 3969/4885PSIP1 3689/4885
US-10221202-B2 Annelated phenoxyacetamides EP300, NAT1, REN HRH3 183/4885LOXL2 3510/4885PSIP1 2907/4885
US-20170050992-A1 NOVEL ANNELATED PHENOXYACETAMIDES EP300, NAT1, AADAC HRH3 125/4885LOXL2 3786/4885PSIP1 3419/4885

“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.