SCHEMBL24768968

SCHEMBL24768968

CC(C)(C)c1cncc(OCC(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.33
AKT1 P31749 1/20 0.33
CNR2 P34972 2/20 0.33
BACE1 P56817 1/20 0.33
KCNH2 Q12809 1/20 0.33
RXRA P19793 3/20 0.32
PPARG P37231 3/20 0.32
CCR6 P51684 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MGLL Q99685 1/20 0.32
ABHD6 Q9BV23 1/20 0.32
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 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
SCHEMBL25744953 0.89 AKT1 (0.35) AKT1CCR6RAB9A
SCHEMBL14004858 0.82 AKT1 (0.41) AKT1
SCHEMBL14005413 0.82 AKT1 (0.41) AKT1
SCHEMBL14004857 0.82 AKT1 (0.41) AKT1
SCHEMBL14005638 0.80 AKT1 (0.42) AKT1
SCHEMBL14004852 0.80 AKT1 (0.42) AKT1
SCHEMBL14004847 0.80 AKT1 (0.42) AKT1
SCHEMBL25857376 0.79 CYP11B1 (0.43) CCR6
SCHEMBL14005149 0.78 AKT1 (0.36) AKT1
SCHEMBL22169042 0.77 PRMT5 (0.33) HDAC6RXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11702422-B2 Imidazopyridazines as modulators of IL-17 JANSSEN PHARMACEUTICA NV (BE) 2023-07-18 US disclosed
US-11691979-B2 Imidazopyridazines as modulators of IL-17 JANSSEN PHARMACEUTICA NV (BE) 2023-07-04 US disclosed
US-20220402922-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 JANSSEN RESEARCH & DEVELOPMENT, LLC 2022-12-22 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-11691979-B2 Imidazopyridazines as modulators of IL-17 IL17A, IL23R, IL15 HDAC6 249/4885AKT1 3322/4885CNR2 947/4885
US-20220402922-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 IL17A, IL23R, IL15 HDAC6 249/4885AKT1 3322/4885CNR2 947/4885
US-11702422-B2 Imidazopyridazines as modulators of IL-17 IL17A, IL23R, IL15 HDAC6 249/4885AKT1 3322/4885CNR2 947/4885

“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.