SCHEMBL23815045

SCHEMBL23815045

CCCC(=O)NC(C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CC(C)C)cc1)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CHRND Q07001 6/20 0.44
▸ CHRNA1 P02708 2/20 0.44
▸ CHRNG P07510 2/20 0.44
▸ CHRNB1 P11230 2/20 0.44
▸ TRPV1 Q8NER1 1/20 0.43
▸ NPY1R P25929 1/20 0.43
▸ NPY2R P49146 1/20 0.43
▸ NPY4R P50391 1/20 0.43
▸ NPY5R Q15761 1/20 0.43
▸ GRIA1 P42261 6/20 0.42
▸ CHRNB2 P17787 1/20 0.42
▸ CHRNB4 P30926 1/20 0.42
▸ CHRNA3 P32297 1/20 0.42
▸ CHRNA4 P43681 1/20 0.42
▸ GRIN1 Q05586 1/20 0.42
▸ GRIN2A Q12879 1/20 0.42
▸ GRM1 Q13255 1/20 0.42

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
SCHEMBL24496495 0.95 TRPV1 (0.45) CHRNDTRPV1NPY1RNPY2RNPY4R
SCHEMBL22702533 0.94 NPY5R (0.47) TRPV1NPY1RNPY2RNPY4RNPY5R
SCHEMBL22336348 0.94 TRPV1 (0.44) TRPV1NPY1RNPY2RNPY4RNPY5R
SCHEMBL22336351 0.94 TRPV1 (0.44) TRPV1NPY1RNPY2RNPY4RNPY5R
SCHEMBL19591557 0.93 FURIN (0.49) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL22746602 0.92 TRPV1 (0.42) TRPV1NPY1RNPY2RNPY4RNPY5R
SCHEMBL24270749 0.92 FURIN (0.43) CHRNDCHRNA1CHRNGCHRNB1GRIA1
SCHEMBL25826708 0.91 NPY4R (0.47) TRPV1NPY1RNPY2RNPY4RNPY5R
SCHEMBL21754508 0.91 NPY4R (0.47) TRPV1NPY1RNPY2RNPY4RNPY5R
SCHEMBL24029087 0.91 TRPV1 (0.43) TRPV1NPY1RNPY2RNPY4RNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220249683-A1 T-CELL DEPLETING THERAPIES HEIDELBERG PHARMA RESEARCH GMBH (DE) 2022-08-11 — — US disclosed
US-20210355230-A1 USE OF ANTI-CD5 ANTIBODY DRUG CONJUGATE (ADC) IN ALLOGENEIC CELL THERAPY HEIDELBERG PHARMA RESEARCH GMBH (DE) 2021-11-18 — — US disclosed
US-20210283267-A1 THERAPEUTIC METHODS USING ANTIBODY DRUG CONJUGATES (ADCS) VOR BIOPHARMA, INC. 2021-09-16 — — 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 (3 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-20210283267-A1 THERAPEUTIC METHODS USING ANTIBODY DRUG CONJUGATES (ADCS) CD44, FCGR1A, FCGR3B CHRND 2747/4885CHRNA1 2364/4885CHRNG 896/4885
US-20210355230-A1 USE OF ANTI-CD5 ANTIBODY DRUG CONJUGATE (ADC) IN ALLOGENEIC CELL THERAPY CD59, CD58, CD2 CHRND 843/4885CHRNA1 748/4885CHRNG 533/4885
US-20220249683-A1 T-CELL DEPLETING THERAPIES CD2, CD4, CD22 CHRND 301/4885CHRNA1 1418/4885CHRNG 571/4885

“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.

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