SCHEMBL23328577

SCHEMBL23328577

CC(C)(C)c1cccc(N2CCN3CCC[C@@H]3C2)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
HDAC4 P56524 1/20 0.49
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL22187761 1.00 ALDH1A1 (0.51) ALDH1A1KMT2AMEN1HDAC4POLB
SCHEMBL14803619 0.84 ALDH1A1 (0.64) ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL19001131 0.83 HRH3 (0.52) KMT2AMEN1
SCHEMBL23328247 0.83 HRH3 (0.52) KMT2AMEN1
SCHEMBL19001066 0.83 HRH3 (0.52) KMT2AMEN1
SCHEMBL24243095 0.78 NOTUM (0.54) HDAC4POLB
SCHEMBL12663092 0.78 MBTD1 (0.61) ALDH1A1HDAC4
SCHEMBL17127953 0.78 MBTD1 (0.61) ALDH1A1HDAC4
SCHEMBL24243040 0.76 ESR1 (0.42) ALDH1A1SMN1; SMN2
SCHEMBL23510813 0.74 KHK (0.47) ALDH1A1

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 ALDH1A1 748/4885KMT2A 3253/4885MEN1 4125/4885
US-20210130353-A1 FGFR INHIBITOR AND APPLICATION THEREOF FGFR1, FGFR4, FGFR2 ALDH1A1 642/4885KMT2A 3272/4885MEN1 4490/4885

“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.