SCHEMBL25877203

SCHEMBL25877203

CC(C)CCN1CCC(CC(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.41
ARG2 P78540 1/20 0.41
CHRM4 P08173 2/20 0.35
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
CCR5 P51681 1/20 0.33
GNAO1 P09471 1/20 0.33
NPY1R P25929 1/20 0.32
OPRL1 P41146 1/20 0.32
CACNA1B Q00975 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
SIGMAR1 Q99720 2/20 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
SCHEMBL24784061 0.86 GNAO1 (0.42) ARG1ARG2CHRM4GNAO1SIGMAR1
SCHEMBL23105099 0.84 ARG1 (0.40) ARG1ARG2CHRM4NOS3NOS1
SCHEMBL23946081 0.81 ARG1 (0.41) ARG1ARG2CHRM4GNAO1NPY1R
SCHEMBL23373022 0.80 PIK3CD (0.39)
SCHEMBL18389282 0.80 ARG1 (0.37) ARG1ARG2CHRM4NOS3NOS1
SCHEMBL10052292 0.80 ARG1 (0.37) ARG1ARG2CHRM4NOS3NOS1
SCHEMBL7320753 0.79 SIGMAR1 (0.43) ARG1ARG2CHRM4SIGMAR1
SCHEMBL22600148 0.79 ARG1 (0.35) ARG1ARG2CHRM4NOS3NOS1
SCHEMBL20805135 0.78 ARG1 (0.45) ARG1ARG2NOS3NOS1NOS2
SCHEMBL22817568 0.78 ARG1 (0.36) ARG1ARG2CHRM4

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-20230226196-A1 COMPOUNDS FOR TARGETED DEGRADATION OF INTERLEUKIN-2-INDUCIBLE T-CELL KINASE AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-07-20 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-20230226196-A1 COMPOUNDS FOR TARGETED DEGRADATION OF INTERLEUKIN-2-INDUCIBLE T-CELL KINASE AND METHODS OF USE ITK, IKZF2, PBK ARG1 3500/4885ARG2 2356/4885CHRM4 4854/4885

“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.