SCHEMBL23479217

SCHEMBL23479217

CC(C)(C)c1cnc2c(F)cccc2c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
PSMD14 O00487 1/20 0.38
COPS5 Q92905 1/20 0.38
ABCB1 P08183 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
ALOX5AP P20292 1/20 0.35
SLC40A1 Q9NP59 2/20 0.34
CCR1 P32246 2/20 0.34
CCR5 P51681 2/20 0.34
CCR8 P51685 2/20 0.34
NPC1 O15118 1/20 0.34
PARP1 P09874 2/20 0.33
MAOB P27338 1/20 0.33
SCD O00767 1/20 0.33

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
SCHEMBL29060953 0.82 ABCB1 (0.35) KDM4EPSMD14COPS5ABCB1ABCG2
SCHEMBL4548616 0.81 KDM4E (0.39) KDM4EPSMD14COPS5SLC40A1CCR1
SCHEMBL21657612 0.81 KDM4E (0.42) KDM4EPSMD14COPS5SLC40A1CCR1
SCHEMBL23478918 0.79 PTPN6 (0.38) KDM4EPSMD14COPS5SLC40A1CCR1
SCHEMBL14327674 0.79 CCR1 (0.52) KDM4EPSMD14COPS5ALOX5APCCR1
SCHEMBL24721913 0.77 PSMD14 (0.39) KDM4EPSMD14COPS5CCR1CCR5
SCHEMBL13222348 0.77 HPGDS (0.57) KDM4ENPC1
SCHEMBL3718782 0.77 KDM4E (0.62) KDM4EPSMD14COPS5ABCB1ABCG2
SCHEMBL20509073 0.76 PARP1 (0.42) KDM4EPSMD14COPS5PARP1
SCHEMBL4819023 0.76 CCR1 (0.42) KDM4EPSMD14COPS5SLC40A1CCR1

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-12030853-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2024-07-09 US disclosed
US-12030853-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2024-07-09 US disclosed
US-20230321049-A1 COMPOSITIONS OF ENPP1 INHIBITORS AND USES THEREOF Petragen, Inc. 2023-10-12 US disclosed
US-20210171461-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2021-06-10 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-20230321049-A1 COMPOSITIONS OF ENPP1 INHIBITORS AND USES THEREOF ENPP1, ENPP2, ENPP3 KDM4E 4063/4885PSMD14 3687/4885COPS5 1732/4885
US-12030853-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 KDM4E 4019/4885PSMD14 1582/4885COPS5 2080/4885
US-20210171461-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 KDM4E 4019/4885PSMD14 1582/4885COPS5 2080/4885

“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.