SCHEMBL25834149

SCHEMBL25834149

C=C1CCC(NCCc2ccccc2)C(=O)N1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 6/20 0.46
TAAR1 Q96RJ0 1/20 0.43
DDB1 Q16531 3/20 0.41
CRBN Q96SW2 3/20 0.41
ROCK2 O75116 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRL1 P41146 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
GRIN1 Q05586 1/20 0.38
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL25834133 0.86 DDB1 (0.43) GRIN2BDDB1CRBNOPRM1OPRL1
SCHEMBL4389099 0.86 CRBN (0.57) GRIN2BDDB1CRBN
SCHEMBL25834441 0.85 DDB1 (0.45) DDB1CRBNALDH1A1
SCHEMBL25834091 0.81 HSD11B1 (0.44) TAAR1DDB1CRBNALDH1A1
SCHEMBL25834128 0.78 DDB1 (0.51) DDB1CRBNALDH1A1
SCHEMBL19606173 0.78 PARP1 (0.39) GRIN2BDDB1CRBN
SCHEMBL4394074 0.77 CRBN (0.54) GRIN2BDDB1CRBNGRIN1SIGMAR1
SCHEMBL26328760 0.75 DDB1 (0.71) DDB1CRBN
SCHEMBL26517208 0.72 CRBN (0.71) DDB1CRBNKMT2A
SCHEMBL25834080 0.71 ALKBH5 (0.56) DDB1CRBNALDH1A1KMT2A

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-20230226035-A1 SMALL MOLECULES AGAINST CEREBLON TO ENHANCE EFFECTOR T CELL FUNCTION H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 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-20230226035-A1 SMALL MOLECULES AGAINST CEREBLON TO ENHANCE EFFECTOR T CELL FUNCTION CD4, CRBN, GZMB GRIN2B 2266/4885TAAR1 4440/4885DDB1 3336/4885

“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.