SCHEMBL25928591

SCHEMBL25928591

CC(=O)Cc1cc(Br)nc(C(C)(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 6/20 0.34
GRN P28799 2/20 0.31
SORT1 Q99523 2/20 0.31
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL25928598 0.87 THRB (0.41) HMGCR
SCHEMBL25938666 0.87 HTT (0.40) HMGCR
SCHEMBL25928580 0.77 HMGCR (0.38) HMGCR
SCHEMBL25928593 0.74 CA5A (0.38) GRNSORT1KDM4ENPC1RAB9A
SCHEMBL25928579 0.74 HMGCR (0.38) HMGCR
SCHEMBL25946249 0.72 HSD17B10 (0.36) HMGCRKDM4E
SCHEMBL25946174 0.72 HMGCR (0.33) HMGCR
SCHEMBL25938655 0.72 HMGCR (0.45) HMGCR
SCHEMBL25928567 0.71 NPC1 (0.38) HMGCRNPC1RAB9A
SCHEMBL18855001 0.71 LMNA (0.47) GRNSORT1POLBNPC1RAB9A

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-20230357199-A1 ARYL, HETEROARYL, AND HETEROCYCLIC PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-11-09 US disclosed
US-11718626-B2 Macrocyclic compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-08-08 US disclosed
US-11708351-B2 Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2023-07-25 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 HMGCR 1705/4885GRN 92/4885SORT1 840/4885
US-11708351-B2 Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders CFD, TFPI, CFH HMGCR 1483/4885GRN 435/4885SORT1 1225/4885
US-20230357199-A1 ARYL, HETEROARYL, AND HETEROCYCLIC PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH HMGCR 1483/4885GRN 435/4885SORT1 1225/4885
US-11814391-B2 Macrocyclic compounds for the treatment of medical disorders CFD, TFPI, CFH HMGCR 789/4885GRN 57/4885SORT1 229/4885

“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.