SCHEMBL24768587

SCHEMBL24768587

CC(C)n1nnnc1C(=O)OI

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.35
▸ ALDH1A1 P00352 6/20 0.33
▸ CYP1A2 P05177 3/20 0.33
▸ CYP2C19 P33261 3/20 0.33
▸ POLB P06746 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HCAR3 P49019 1/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.33
▸ NPC1 O15118 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ CYP2D6 P10635 2/20 0.31
▸ CYP2C9 P11712 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ KMT2A Q03164 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
SCHEMBL24768588 0.82 ALDH1A1 (0.35) TDP1ALDH1A1CYP1A2CYP2C19POLB
SCHEMBL23990683 0.79 MAPK1 (0.41) TDP1ALDH1A1CYP1A2POLBHPGD
SCHEMBL24844592 0.76 ALDH1A1 (0.31) ALDH1A1POLBNPC1RAB9A
SCHEMBL12145804 0.66 HPGD (0.39) ALDH1A1HPGDMEN1KMT2A
SCHEMBL8924384 0.61 MAPK1 (0.34) POLBHPGDHCAR3HCAR2NPC1
SCHEMBL19860035 0.60 MCOLN2 (0.40) TDP1ALDH1A1CYP1A2CYP2C19POLB
SCHEMBL840930 0.60 NPSR1 (0.41) ALDH1A1CYP1A2HPGDHCAR3HCAR2
SCHEMBL23990518 0.59 — —
SCHEMBL4407825 0.59 — —
SCHEMBL3264142 0.59 — —

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-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 (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-11691979-B2 Imidazopyridazines as modulators of IL-17 IL17A, IL23R, IL15 TDP1 3424/4885ALDH1A1 164/4885CYP1A2 110/4885
US-20220402922-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 IL17A, IL23R, IL15 TDP1 3424/4885ALDH1A1 164/4885CYP1A2 110/4885

“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.

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