SCHEMBL23320104

SCHEMBL23320104

CCNCCCOCCOCCOCCCNC(=O)CCCC(=O)NCCCCC(C)C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
GLP1R P43220 8/20 0.39
CNR1 P21554 1/20 0.39
EPOR P19235 1/20 0.38
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
CASP2 P42575 1/20 0.37
NAMPT P43490 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
SCHEMBL19155468 0.86 TSHR (0.50) TSHRHPGDSMN1; SMN2GLP1RCNR1
SCHEMBL23320108 0.85 TSHR (0.47) TSHRHPGDSMN1; SMN2GLP1RCNR1
SCHEMBL24253269 0.85 TSHR (0.47) TSHRHPGDSMN1; SMN2GLP1REPOR
SCHEMBL23320105 0.84 CASP2 (0.46) CNR1LMNAPKMCASP2NAMPT
SCHEMBL12312753 0.84 SMN1; SMN2 (0.55) TSHRHPGDSMN1; SMN2LMNAPKM
SCHEMBL25978308 0.84 TSHR (0.51) TSHRHPGDSMN1; SMN2GLP1RCNR1
SCHEMBL23334540 0.84 TSHR (0.51) TSHRHPGDSMN1; SMN2CNR1LMNA
SCHEMBL25793735 0.83 HPGD (0.40) TSHRHPGDSMN1; SMN2GLP1RCNR1
SCHEMBL16159250 0.83 TSHR (0.70) TSHRHPGDSMN1; SMN2CNR1LMNA
SCHEMBL25793668 0.83 CASP2 (0.47) CNR1LMNAPKMCASP2NAMPT

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-11634450-B2 DOT1L degraders and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-04-25 US disclosed
US-20210130386-A1 DOT1L DEGRADERS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 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-20210130386-A1 DOT1L DEGRADERS AND USES THEREOF CRBN, CUL1, STUB1 TSHR 3358/4885HPGD 4011/4885SMN1; SMN2 1538/4885
US-11634450-B2 DOT1L degraders and uses thereof CRBN, CUL1, STUB1 TSHR 3358/4885HPGD 4011/4885SMN1; SMN2 1538/4885

“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.