SCHEMBL22601646

SCHEMBL22601646

CC(C)(Cc1cnc[nH]1)[Si](C)(C)Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.45
PKM P14618 1/20 0.44
HRH3 Q9Y5N1 12/20 0.43
HRH4 Q9H3N8 8/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
RECQL P46063 1/20 0.42
PMP22 Q01453 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GLA P06280 1/20 0.42
MAPT P10636 1/20 0.42
CYP1A2 P05177 1/20 0.42
NFKB1 P19838 1/20 0.42
THPO P40225 1/20 0.42
LMNA P02545 2/20 0.41
HRH2 P25021 2/20 0.41
MIF P14174 1/20 0.41

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
SCHEMBL502104 0.78 PKM (0.52) FDPSPKMHRH3HRH4KDM4E
SCHEMBL21306102 0.74 PKM (0.44) PKMHRH3HRH4KDM4EPOLB
SCHEMBL28813959 0.70 PKM (0.52) FDPSPKMHRH3HRH4KDM4E
SCHEMBL5692256 0.68 FDPS (0.54) FDPSPKMHRH3HRH4KDM4E
SCHEMBL26437620 0.68 HRH3 (0.58) FDPSPKMHRH3HRH4
SCHEMBL226696 0.68 TAAR1 (0.51) HRH3HRH4ADRA1D
SCHEMBL14003877 0.67 HRH3 (0.55) PKMHRH3HRH4KDM4EPOLB
SCHEMBL12056289 0.67 HRH3 (0.65) FDPSHRH3HRH4ALDH1A1MEN1
SCHEMBL2264740 0.67 ARG1 (0.53) FDPSPKMHRH3HRH4KDM4E
SCHEMBL2264734 0.67 ARG1 (0.53) FDPSPKMHRH3HRH4KDM4E

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-20200338208-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF ABBVIE INC. (US) 2020-10-29 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-20200338208-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF NR3C1, NR3C2, MC2R FDPS 4247/4885PKM 4684/4885HRH3 495/4885

“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.