SCHEMBL21991992

SCHEMBL21991992

COC(=O)C(C)C(C)COc1ccc(F)c(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 1/20 0.39
PARP10 Q53GL7 1/20 0.39
BACE1 P56817 2/20 0.39
HCRTR2 O43614 1/20 0.39
MTNR1A P48039 3/20 0.39
MTNR1B P49286 3/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL21991937 0.90 TDP1 (0.39) PARP15PARP10HCRTR2
SCHEMBL21992679 0.90 HIF1A (0.40) PARP15PARP10HCRTR2
SCHEMBL23605986 0.88 FFAR1 (0.43) PARP15PARP10BACE1
SCHEMBL21992574 0.81 MEN1 (0.41) BACE1TP53
SCHEMBL21991567 0.80 TSHR (0.43)
SCHEMBL21991346 0.80 ALDH1A1 (0.49) MTNR1AMTNR1B
SCHEMBL21991336 0.77 CYP1A2 (0.50)
SCHEMBL23606004 0.77 POLB (0.46)
SCHEMBL24418987 0.76 HIF1A (0.40) PARP15PARP10
SCHEMBL21991931 0.75 BACE1 (0.40) BACE1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220409566-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-12-29 US disclosed
US-20220142961-A1 CCL5 Inhibitors LAPKO INC, dba AFECTA PHARMACEUTICALS 2022-05-12 US disclosed
US-11318111-B2 CCL5 inhibitors LAPKO INC (US) 2022-05-03 US disclosed
US-20210196665-A1 CCL5 Inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-07-01 US disclosed
US-10940132-B2 CCL5 inhibitors AFECTA PHARMACEUTICALS, INC. (US) 2021-03-09 US disclosed
US-20200138766-A1 CCL5 INHIBITORS LAPKO INC. DBA AFECTA PHARMACEUTICALS 2020-05-07 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 (6 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-20220142961-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PARP15 1242/4885PARP10 1430/4885BACE1 1133/4885
US-20200138766-A1 CCL5 INHIBITORS CCL5, CCL11, CCR5 PARP15 1242/4885PARP10 1430/4885BACE1 1133/4885
US-20210196665-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PARP15 1242/4885PARP10 1430/4885BACE1 1133/4885
US-10940132-B2 CCL5 inhibitors CCL5, CCL11, CCR5 PARP15 1242/4885PARP10 1430/4885BACE1 1133/4885
US-11318111-B2 CCL5 inhibitors CCL5, CCL11, CCR5 PARP15 1242/4885PARP10 1430/4885BACE1 1133/4885
US-20220409566-A1 CCL5 Inhibitors CCL5, CCL11, CCR5 PARP15 1242/4885PARP10 1430/4885BACE1 1133/4885

“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.