SCHEMBL23964497

SCHEMBL23964497

CC(C)(C)Cc1cccc(C=O)n1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.36
TERT O14746 14/20 0.34
ALDH1A1 P00352 1/20 0.33
CCR4 P51679 1/20 0.33
GRN P28799 1/20 0.32
SORT1 Q99523 1/20 0.32
MEN1 O00255 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL2476938 0.80 KCNH2 (0.41) CCR4GRNSORT1MEN1OPRM1
SCHEMBL249047 0.79 CCR1 (0.40) CCR1TERTALDH1A1
SCHEMBL22335908 0.78 KCNH2 (0.42) CCR1TERTNPSR1
SCHEMBL12664449 0.78 KCNH2 (0.45) CCR1TERTALDH1A1NPSR1
SCHEMBL21357417 0.77 TERT (0.34) CCR1TERTALDH1A1
SCHEMBL29368972 0.77 TERT (0.34) CCR1TERTALDH1A1
SCHEMBL7095200 0.76 KCNH2 (0.46) CCR1TERTALDH1A1NPSR1
SCHEMBL947122 0.75 BACE1 (0.36) CCR1TERT
SCHEMBL22354808 0.75 CCR1 (0.40) CCR1TERTALDH1A1
SCHEMBL6984612 0.75 CCR1 (0.40) CCR1TERTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210338834-A1 DEGRADABLE HYALURONIC ACID HYDROGELS ASCENDIS PHARMA A/S (DK) 2021-11-04 US disclosed
US-20210330798-A1 TREATMENT OF INFECTIONS ASCENDIS PHARMA A/S (DK) 2021-10-28 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 (2 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-20210338834-A1 DEGRADABLE HYALURONIC ACID HYDROGELS CD44, HPSE, MMP13 CCR1 2351/4885TERT 3725/4885ALDH1A1 101/4885
US-20210330798-A1 TREATMENT OF INFECTIONS H1-10, PM20D2, ELANE CCR1 420/4885TERT 4323/4885ALDH1A1 1667/4885

“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.