SCHEMBL24335014

SCHEMBL24335014

CCCCCCC1CCOCC1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
EPHX1 P07099 1/20 0.54
CYP1A2 P05177 4/20 0.53
PKM P14618 1/20 0.51
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.45
HPGD P15428 1/20 0.45
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
TLR7 Q9NYK1 2/20 0.38
TP53 P04637 1/20 0.37
LSS P48449 2/20 0.37
SIGMAR1 Q99720 2/20 0.36
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL11691068 1.00 HTT (0.54) HTTMEN1KMT2AEPHX1CYP1A2
SCHEMBL20350178 1.00 HTT (0.54) HTTMEN1KMT2AEPHX1CYP1A2
SCHEMBL1603327 0.98 CYP1A2 (0.55) HTTMEN1KMT2AEPHX1CYP1A2
SCHEMBL27473643 0.92 CYP1A2 (0.52) HTTMEN1KMT2AEPHX1CYP1A2
SCHEMBL3167257 0.91 CYP1A2 (0.58) HTTMEN1KMT2AEPHX1CYP1A2
SCHEMBL25882647 0.89 CYP1A2 (0.59) HTTMEN1KMT2AEPHX1CYP1A2
SCHEMBL14040310 0.87 CYP1A2 (0.50) HTTMEN1KMT2AEPHX1CYP1A2
SCHEMBL3987478 0.87 CYP1A2 (0.50) HTTMEN1KMT2AEPHX1CYP1A2
SCHEMBL7908823 0.84 CYP1A2 (0.52) HTTMEN1KMT2AEPHX1CYP1A2
SCHEMBL6753110 0.83 CYP1A2 (0.59) HTTMEN1KMT2AEPHX1CYP1A2

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-20230002361-A1 2H-INDAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE BIOGEN MA INC. 2023-01-05 US disclosed
US-20220089592-A1 IMIDAZO[1,2-A]PYRIDINYL DERIVATIVES AS IRAK4 INHIBITORS BIOGEN MA INC. 2022-03-24 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-20230002361-A1 2H-INDAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE IRAK4, IRAK3, IRAK2 HTT 3351/4885MEN1 954/4885KMT2A 239/4885
US-20220089592-A1 IMIDAZO[1,2-A]PYRIDINYL DERIVATIVES AS IRAK4 INHIBITORS IRAK4, IRAK2, IRAK1 HTT 4643/4885MEN1 625/4885KMT2A 211/4885

“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.