SCHEMBL25628893

SCHEMBL25628893

CC(C)C(=O)N1CCN(C(C)C)C(c2ccccc2C(C)C)C1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.38
RIPK1 Q13546 1/20 0.36
HRH3 Q9Y5N1 3/20 0.34
TSHR P16473 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.34
MTNR1A P48039 2/20 0.34
MTNR1B P49286 2/20 0.34
ALOX15 P16050 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TBXA2R P21731 1/20 0.34
AVPR1A P37288 1/20 0.34
GLA P06280 1/20 0.33
NAMPT P43490 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL25613545 0.82 PKM (0.36) PKMRIPK1TSHRSMN1; SMN2LMNA
SCHEMBL25628791 0.78 HTR2A (0.40) TSHRSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL25479228 0.76 PROKR1 (0.48)
SCHEMBL25628692 0.75 ALDH1A1 (0.37) TSHRSMN1; SMN2KMT2ANPSR1
SCHEMBL25628656 0.75 L3MBTL1 (0.36) MEN1KMT2A
SCHEMBL25480483 0.74 MEN1 (0.34) LMNAALOX15MEN1KMT2ANPSR1
SCHEMBL25492871 0.74 MAPK1 (0.42) PKMLMNAKMT2AGLA
SCHEMBL24005504 0.74 P2RX7 (0.41) LMNAALOX15MEN1KMT2A
SCHEMBL24005474 0.73 USP1 (0.35) ALOX15NPSR1
SCHEMBL25478787 0.73 KMT2A (0.38) HRH3LMNAALOX15MEN1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159527-A1 COMPOUNDS AS BCL-2 INHIBITORS FOCHON BIOSCIENCES, LTD. (CN) 2023-05-25 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-20230159527-A1 COMPOUNDS AS BCL-2 INHIBITORS BCL2, BCL2L2, BCL2L1 PKM 3454/4885RIPK1 1106/4885HRH3 4673/4885

“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.