SCHEMBL26311798

SCHEMBL26311798

CC(C)(C)N(CC(=O)O)CC(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 2/20 0.36
HMGCR P04035 1/20 0.36
CHRM1 P11229 1/20 0.36
TBXA2R P21731 1/20 0.36
TDP1 Q9NUW8 2/20 0.32
EYA2 O00167 1/20 0.32
APP P05067 1/20 0.32
ACE P12821 1/20 0.32
MLYCD O95822 1/20 0.31
TSHR P16473 3/20 0.31
CYP2C19 P33261 2/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CHRM2 P08172 1/20 0.31
ADRA2A P08913 1/20 0.31
ALOX15 P16050 1/20 0.31
DRD1 P21728 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
DRD3 P35462 1/20 0.31

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
SCHEMBL26309085 0.83
SCHEMBL10197374 0.82 TDP1 (0.35) ADRA1AHMGCRCHRM1TBXA2RTDP1
SCHEMBL783010 0.81 TDP1 (0.41) ADRA1AHMGCRCHRM1TBXA2RTDP1
SCHEMBL24709971 0.79 TDP1 (0.36) ADRA1ATDP1EYA2APPACE
SCHEMBL22291050 0.77 TDP1 (0.35) ADRA1AHMGCRCHRM1TBXA2RTDP1
SCHEMBL22734368 0.75
SCHEMBL3871128 0.75 FFAR3 (0.36) ADRA1AHMGCRCHRM1TBXA2RTDP1
SCHEMBL11800317 0.74 ADRA1A (0.43) ADRA1AHMGCRCHRM1TBXA2RTDP1
SCHEMBL1547956 0.74 ADRA1A (0.43) ADRA1AHMGCRCHRM1TBXA2RTDP1
SCHEMBL14199728 0.73 TDP1 (0.35) ADRA1AHMGCRCHRM1TBXA2RTDP1

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-11760761-B2 Methods and compositions for targeting PD-L1 ALIGOS THERAPEUTICS, INC. (US) 2023-09-19 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-11760761-B2 Methods and compositions for targeting PD-L1 CD274, PDCD1LG2, PDCD1 ADRA1A 2516/4885HMGCR 1520/4885CHRM1 4314/4885

“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.