SCHEMBL25876336

SCHEMBL25876336

COC(=O)C1(OC)CCC(c2nc(Cl)c3ncn(C)c3n2)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEAD1 P28347 2/20 0.34
TEAD4 Q15561 2/20 0.34
TEAD2 Q15562 2/20 0.34
TEAD3 Q99594 2/20 0.34
YTHDC1 Q96MU7 1/20 0.33
CDK1 P06493 4/20 0.32
ADORA1 P30542 2/20 0.32
TMIGD3 P0DMS9 1/20 0.32
CYP2C9 P11712 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
ACHE P22303 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
PKM P14618 1/20 0.31
NFKB1 P19838 1/20 0.31
THPO P40225 1/20 0.31
PMP22 Q01453 1/20 0.31
CCNE2 O96020 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
SCHEMBL18789233 0.71 CBLB (0.36) HTR2C
SCHEMBL18789262 0.68 JAK2 (0.36)
SCHEMBL22701715 0.66 ALDH1A1 (0.38) CYP2C9CYP1A2CYP3A4ALDH1A1
SCHEMBL18789249 0.65 CYP1A2 (0.39) CYP2C9CYP1A2
SCHEMBL18789255 0.65 ALDH1A1 (0.36) ALDH1A1
SCHEMBL18789264 0.65 JAK2 (0.36)
SCHEMBL18849454 0.64 JAK2 (0.34)
SCHEMBL18789261 0.63 RET (0.56)
SCHEMBL29695944 0.63 LDHA (0.38)
SCHEMBL7289687 0.63 CDK1 (0.51) YTHDC1CDK1ADORA1CYP1A2CYP3A4

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-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF TYK MEDICINES, INC. (CN) 2023-07-27 US disclosed
US-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF TYK MEDICINES, INC. (CN) 2023-07-27 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 (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-20230234954-A1 COMPOUND USED AS RET KINASE INHIBITOR AND APPLICATION THEREOF RET, ROR1, FGFR3 TEAD1 1538/4885TEAD4 1576/4885TEAD2 1354/4885

“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.