SCHEMBL23613237

SCHEMBL23613237

CC(C)(C)COCCCCCNC(=O)C(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
EPHX1 P07099 1/20 0.41
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
HIF1A Q16665 1/20 0.38
DRD4 P21917 3/20 0.37
DRD2 P14416 2/20 0.37
EPHX2 P34913 1/20 0.37
ACHE P22303 6/20 0.37
GBA2 Q9HCG7 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
SCHEMBL24451143 0.93 POLB (0.45) POLBMEN1KMT2AEPHX1ALDH1A1
SCHEMBL24966292 0.86 POLB (0.41) POLBMEN1KMT2AEPHX1ALDH1A1
SCHEMBL22650107 0.85 POLB (0.40) POLBMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL23888839 0.83 EPHX1 (0.37) POLBMEN1KMT2AEPHX1TDP1
SCHEMBL20758283 0.83 POLB (0.36) POLBMEN1KMT2AEPHX1ALDH1A1
SCHEMBL14524176 0.83 EPHX2 (0.50) POLBMEN1KMT2AEPHX1SMN1; SMN2
SCHEMBL10633351 0.82 MEN1 (0.58) POLBMEN1KMT2AEPHX1ALDH1A1
SCHEMBL24451194 0.81 POLB (0.38) POLBMEN1KMT2AEPHX1ALDH1A1
SCHEMBL18622113 0.80 POLB (0.57) POLBMEN1KMT2AEPHX1ALDH1A1
SCHEMBL25727664 0.80 POLB (0.39) POLBMEN1KMT2AEPHX1ALDH1A1

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-11814391-B2 Macrocyclic compounds for the treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-11-14 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 (4 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 POLB 2977/4885MEN1 139/4885KMT2A 4577/4885
US-11053253-B2 Macrocyclic compounds for treatment of medical disorders CFD, TFPI, CFH POLB 2977/4885MEN1 139/4885KMT2A 4577/4885
US-20210300934-A1 MACROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH POLB 2977/4885MEN1 139/4885KMT2A 4577/4885
US-11814391-B2 Macrocyclic compounds for the treatment of medical disorders CFD, TFPI, CFH POLB 3209/4885MEN1 108/4885KMT2A 4672/4885

“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.