SCHEMBL23613344

SCHEMBL23613344

CN(CC(C)(C)C)C(=O)CCCCCCC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 1/20 0.39
▸ ACACA Q13085 1/20 0.39
▸ ACLY P53396 1/20 0.36
▸ EPHX2 P34913 2/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ CYP4F2 P78329 1/20 0.33
▸ CYP4A11 Q02928 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ KDM4A O75164 10/20 0.33
▸ KDM4C Q9H3R0 10/20 0.33
▸ KDM5A P29375 1/20 0.33
▸ KDM7A Q6ZMT4 1/20 0.33
▸ PHF8 Q9UPP1 1/20 0.33
▸ KDM2A Q9Y2K7 1/20 0.33
▸ FFAR1 O14842 1/20 0.32
▸ CPT2 P23786 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ BCHE P06276 1/20 0.32

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
SCHEMBL22021658 0.85 EPHX2 (0.41) ACACBACACAEPHX2KDM4AKDM4C
SCHEMBL22021685 0.85 EPHX2 (0.41) ACACBACACAEPHX2KDM4AKDM4C
SCHEMBL22021680 0.85 EPHX2 (0.41) ACACBACACAEPHX2KDM4AKDM4C
SCHEMBL17615113 0.84 NPC1 (0.31) —
SCHEMBL23613545 0.82 ACLY (0.41) ACACBACACAACLYCYP4F2CYP4A11
SCHEMBL8567763 0.82 ALDH1A1 (0.52) ACACBACACAHDAC1HDAC2HDAC6
SCHEMBL10388290 0.80 ALOX5 (0.44) HDAC1HDAC2HDAC6ALDH1A1KDM4A
SCHEMBL10389155 0.80 ALOX5 (0.44) HDAC1HDAC2HDAC6ALDH1A1KDM4A
SCHEMBL13617194 0.79 ALDH1A1 (0.54) HDAC1HDAC2HDAC6ALDH1A1KDM4A
SCHEMBL19756268 0.78 HDAC1 (0.35) ACACBACACAHDAC1HDAC2HDAC6

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-11718626-B2 Macrocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-08-08 — — US disclosed
US-11718626-B2 Macrocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-08-08 — — US disclosed
US-20210300934-A1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2021-09-30 — — US disclosed
US-11053253-B2 Macrocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2021-07-06 — — 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-11718626-B2 Macrocyclic compounds for treatment of medical disorders CFD, TFPI, CFH ACACB 3025/4885ACACA 2956/4885ACLY 3962/4885
US-11053253-B2 Macrocyclic compounds for treatment of medical disorders CFD, TFPI, CFH ACACB 3025/4885ACACA 2956/4885ACLY 3962/4885
US-20210300934-A1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH ACACB 3025/4885ACACA 2956/4885ACLY 3962/4885

“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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