SCHEMBL26683973

SCHEMBL26683973

O=C1CCN(c2cc(N3CCNCC3)cc3[nH]ccc23)C(=O)N1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRB1 P08588 4/20 0.45
▸ HTR6 P50406 3/20 0.45
▸ CRBN Q96SW2 8/20 0.40
▸ DDB1 Q16531 7/20 0.40
▸ CHRM2 P08172 1/20 0.36
▸ CHRM4 P08173 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ CHRM3 P20309 1/20 0.36
▸ HRH4 Q9H3N8 1/20 0.34
▸ HTR2C P28335 2/20 0.33
▸ HTR3E A5X5Y0 1/20 0.33
▸ HTR3B O95264 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HTR2A P28223 1/20 0.33

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
SCHEMBL25428415 0.82 DRD4 (0.55) CRBNDDB1DRD3
SCHEMBL25430794 0.79 CRBN (0.45) ADRB1HTR6CRBNDDB1PIM1
SCHEMBL26684128 0.77 DDB1 (0.40) ADRB1HTR6CRBNDDB1CHRM2
SCHEMBL30449960 0.77 CRBN (0.42) ADRB1HTR6CRBNDDB1HRH4
SCHEMBL26683597 0.77 CRBN (0.42) ADRB1HTR6CRBNDDB1HRH4
Hydrochloric Acid SCHEMBL29507051 0.76 CRBN (0.41) ADRB1HTR6CRBNDDB1HRH4
SCHEMBL31306692 0.75 DDB1 (0.56) ADRB1HTR6CRBNDDB1HTR2C
SCHEMBL30266979 0.75 ADRB1 (0.54) ADRB1HTR6CRBNDDB1CHRM2
SCHEMBL26112333 0.74 CRBN (0.54) ADRB1HTR6CRBNDDB1DRD3
SCHEMBL26683968 0.74 CRBN (0.48) CRBNDDB1

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-20230374007-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-11-23 — — US disclosed
US-20230374007-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-11-23 — — US disclosed
US-20230374007-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-11-23 — — US disclosed
CN-116249554-A Compounds and their use in the treatment of cancer 阿斯利康(瑞典)有限公司 2023-06-09 — — CN 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-20230374007-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER RARA, RARG, RARB ADRB1 4493/4885HTR6 4280/4885CRBN 2312/4885

“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.

Send feedback