SCHEMBL23328643

SCHEMBL23328643

CC(C)c1ccc(N2C[C@@H](C)N[C@@H](C)C2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
CHRM1 P11229 1/20 0.43
PTGS1 P23219 1/20 0.43
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
PTPN11 Q06124 2/20 0.38
GHSR Q92847 3/20 0.37
HTR6 P50406 1/20 0.37
MCOLN3 Q8TDD5 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
XIAP P98170 1/20 0.36
BIRC2 Q13490 1/20 0.36
HPGD P15428 1/20 0.35
ACACB O00763 1/20 0.34
SLC6A2 P23975 2/20 0.34
SLC6A4 P31645 2/20 0.34
SLC6A3 Q01959 2/20 0.34
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL20883665 0.85 ALDH1A1 (0.57) HTTCHRM1PTGS1ALDH1A1LMNA
SCHEMBL20883666 0.85 ALDH1A1 (0.57) HTTCHRM1PTGS1ALDH1A1LMNA
SCHEMBL23328642 0.83 HTT (0.39) HTTPTGS1LMNAGHSRHTR6
SCHEMBL23328644 0.83 HTT (0.39) HTTGHSRL3MBTL1XIAPBIRC2
SCHEMBL4933476 0.81 HTT (0.51) HTTALDH1A1LMNAPTPN11GHSR
SCHEMBL4933480 0.81 HTT (0.51) HTTALDH1A1LMNAPTPN11GHSR
SCHEMBL23328645 0.81 GHSR (0.43) ALDH1A1GHSRACACB
SCHEMBL26406996 0.80 HTT (0.50) HTTALDH1A1LMNAPTPN11GHSR
SCHEMBL13239751 0.77 L3MBTL1 (0.45) HTTALDH1A1GHSRL3MBTL1HPGD
SCHEMBL25897985 0.77 L3MBTL1 (0.45) HTTALDH1A1GHSRL3MBTL1HPGD

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-11365196-B2 FGFR inhibitor and application thereof BETTA PHARMACEUTICALS CO., LTD. (CN) 2022-06-21 US disclosed
US-20210130353-A1 FGFR INHIBITOR AND APPLICATION THEREOF BETTA PHARMACEUTICALS CO., LTD. (CN) 2021-05-06 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-11365196-B2 FGFR inhibitor and application thereof FGFR1, FGFR4, FGFR2 HTT 3713/4885CHRM1 4838/4885PTGS1 1028/4885
US-20210130353-A1 FGFR INHIBITOR AND APPLICATION THEREOF FGFR1, FGFR4, FGFR2 HTT 3679/4885CHRM1 4844/4885PTGS1 771/4885

“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.