SCHEMBL24997896

SCHEMBL24997896

CC(C)NC(=O)C1CCCCC(CC(C)NC(=O)c2ccccc2)CCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 0.51
▸ CTSL P07711 1/20 0.51
▸ CTSB P07858 1/20 0.51
▸ CTSS P25774 1/20 0.51
▸ CTSK P43235 1/20 0.51
▸ LMNA P02545 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ RAB9A P51151 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ KCNK3 O14649 1/20 0.43
▸ KCNK9 Q9NPC2 1/20 0.43
▸ CHRNB2 P17787 1/20 0.43
▸ CHRNB4 P30926 1/20 0.43
▸ CHRNA3 P32297 1/20 0.43
▸ CHRNA4 P43681 1/20 0.43
▸ USP30 Q70CQ3 1/20 0.42
▸ MTNR1A P48039 1/20 0.42
▸ MTNR1B P49286 1/20 0.42
▸ MEN1 O00255 1/20 0.42

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
SCHEMBL20325059 0.78 CTSL (0.46) CTSLCTSBCTSSCTSKALDH1A1
SCHEMBL1123422 0.77 CTSL (0.48) CTSLCTSBCTSSCTSKALDH1A1
SCHEMBL19539199 0.73 CHRNB2 (0.45) RECQLCTSKLMNAPOLBHPGD
SCHEMBL18127223 0.72 GRN (0.69) CTSLCTSBCTSSCTSKCHRNB2
SCHEMBL29137460 0.72 RAB9A (0.67) CTSLCTSBCTSSCTSKLMNA
Propylhexedrine SCHEMBL20590931 0.71 CTSL (0.48) RECQLCTSLCTSBCTSSCTSK
SCHEMBL19538483 0.71 RAB9A (0.48) CTSLCTSBCTSSCTSKLMNA
SCHEMBL5506241 0.71 CTSL (0.57) CTSLCTSBCTSSCTSKCHRNB2
SCHEMBL10119265 0.71 CTSS (0.69) CTSLCTSBCTSSCTSKCHRNB2
SCHEMBL24380333 0.71 CCR3 (0.51) CTSLCTSBCTSSCTSKLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230038589-A1 Methods and compositions for targeting Tregs using CCR8 inhibitors Nanjing Immunophage Biotech Co., Ltd. (CN) 2023-02-09 — — 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 (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-20230038589-A1 Methods and compositions for targeting Tregs using CCR8 inhibitors CCR8, CCR1, CCR3 RECQL 3304/4885CTSL 2830/4885CTSB 1919/4885

“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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