SCHEMBL24476317

SCHEMBL24476317

Cc1nc2c(Cl)nc(Cl)nc2n1CCCCCCCCCCCCCCCCO

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.36
▸ CYP3A4 P08684 6/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ KMT2A Q03164 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ CSNK2A1 P68400 3/20 0.31
▸ ALOX15 P16050 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ HSP90AB1 P08238 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ CSNK2A2 P19784 1/20 0.31
▸ CSNK2B P67870 1/20 0.31
▸ CSNK2A3 Q8NEV1 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
SCHEMBL24476493 0.80 FAAH (0.48) TSHRCYP3A4CSNK2A1CSNK2A2CSNK2B
SCHEMBL24476284 0.80 KAT2B (0.40) TSHR
SCHEMBL24476531 0.78 — —
SCHEMBL24476587 0.77 CSNK2A1 (0.32) CSNK2A1
SCHEMBL24476358 0.77 TSHR (0.33) TSHRKMT2ACSNK2A1PIM1CSNK2A2
SCHEMBL24476318 0.77 TSHR (0.33) TSHRKMT2ACSNK2A1PIM1CSNK2A2
SCHEMBL31625100 0.71 KDM4E (0.38) KDM4E
SCHEMBL15600397 0.71 KDM4E (0.38) KDM4E
SCHEMBL8464465 0.71 TK1 (0.51) CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL10871605 0.68 PNP (0.59) TSHRHSD17B10

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-20220168309-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF DISEASE INVOX PHARMA LIMITED (GB) 2022-06-02 — — US disclosed
US-20220168309-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF DISEASE INVOX PHARMA LIMITED (GB) 2022-06-02 — — US disclosed
CN-113645977-A Compounds, compositions and methods for treatment of disease F-星治疗公司 2021-11-12 — — CN 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 (1 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-20220168309-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF DISEASE STING1, CGAS, MAVS TSHR 3225/4885CYP3A4 4749/4885SMN1; SMN2 1704/4885

“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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