SCHEMBL22728678

SCHEMBL22728678

CC(C)N1CC(c2ccccc2)N(C)C1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
ATM Q13315 1/20 0.43
BRD4 O60885 3/20 0.40
RIPK1 Q13546 2/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
SRD5A1 P18405 1/20 0.38
KMT2A Q03164 5/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TSHR P16473 2/20 0.37
RAB9A P51151 1/20 0.37
P2RX7 Q99572 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
SCHEMBL20794007 1.00 ALDH1A1 (0.43) ALDH1A1ATMBRD4RIPK1CHRNB2
SCHEMBL8035590 0.81 ALDH1A1 (0.38) ALDH1A1ATMBRD4RIPK1KMT2A
SCHEMBL10533429 0.79 RIPK1 (0.52) ALDH1A1ATMBRD4RIPK1CHRNB2
SCHEMBL10041517 0.79 RIPK1 (0.52) ALDH1A1ATMBRD4RIPK1CHRNB2
SCHEMBL20794010 0.79 RIPK1 (0.52) ALDH1A1ATMBRD4RIPK1CHRNB2
SCHEMBL20780480 0.74 TACR1 (0.37)
SCHEMBL22728675 0.73 RIPK1 (0.45) ALDH1A1ATMBRD4RIPK1CHRNB2
SCHEMBL20794089 0.70 CETP (0.33) P2RX7
SCHEMBL14554141 0.69 MAPT (0.37) KMT2AMEN1MAPTTSHRP2RX7
SCHEMBL6439879 0.68 GAA (0.44) ALDH1A1ATMBRD4RIPK1CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240025878-A1 MDM2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2024-01-25 US disclosed
US-11746120-B2 Stat degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-09-05 US disclosed
US-20230135894-A1 MK2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-04 US disclosed
US-11358948-B2 CRBN ligands and uses thereof KYMERA THERAPEUTICS, INC. (US) 2022-06-14 US disclosed
US-20200377469-A1 CRBN LIGANDS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2020-12-03 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 (5 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-20200377469-A1 CRBN LIGANDS AND USES THEREOF CRBN, CRKL, ERBB3 ALDH1A1 4145/4885ATM 1051/4885BRD4 1883/4885
US-20230135894-A1 MK2 DEGRADERS AND USES THEREOF MKNK2, MKRN3, DUS2 ALDH1A1 2904/4885ATM 1642/4885BRD4 856/4885
US-20240025878-A1 MDM2 DEGRADERS AND USES THEREOF MDM2, TP53, MDM4 ALDH1A1 1804/4885ATM 564/4885BRD4 643/4885
US-11358948-B2 CRBN ligands and uses thereof CRBN, CRKL, ERBB3 ALDH1A1 4145/4885ATM 1051/4885BRD4 1883/4885
US-11746120-B2 Stat degraders and uses thereof STAT4, STAT1, STAT3 ALDH1A1 2465/4885ATM 837/4885BRD4 862/4885

“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.