SCHEMBL30104067

SCHEMBL30104067

N[C@@H](Cc1ccc2ccccc2c1)C(=O)NCC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.54
NLN Q9BYT8 1/20 0.53
DPP4 P27487 1/20 0.51
HTR2A P28223 1/20 0.49
HTR2C P28335 1/20 0.49
HTR2B P41595 1/20 0.49
MME P08473 3/20 0.48
ACE P12821 2/20 0.48
CPA1 P15085 1/20 0.48
ACE2 Q9BYF1 1/20 0.48
CTSC P53634 1/20 0.47
MC4R P32245 2/20 0.47
MC5R P33032 2/20 0.47
MC3R P41968 2/20 0.47
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL5556817 0.86 NLN (0.62) OPRD1NLNDPP4HTR2AHTR2C
SCHEMBL26605069 0.84 OPRD1 (0.56) OPRD1NLNDPP4HTR2AHTR2C
SCHEMBL26605072 0.84 OPRD1 (0.56) OPRD1NLNDPP4HTR2AHTR2C
SCHEMBL5558741 0.84 CA12 (0.52) OPRD1NLNDPP4MC4RMC5R
SCHEMBL6019536 0.84 CTSS (0.61) OPRD1NLNDPP4HTR2AHTR2C
SCHEMBL6047673 0.84 MME (0.62) MMEACECTSCALDH1A1HPGD
SCHEMBL1329817 0.84 MME (0.62) MMEACECTSCALDH1A1HPGD
SCHEMBL1329815 0.84 MME (0.62) MMEACECTSCALDH1A1HPGD
SCHEMBL23142774 0.83 OPRD1 (0.63) OPRD1MMEACECPA1ACE2
SCHEMBL1769595 0.83 NLN (0.50) OPRD1NLNDPP4HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240252693-A1 FOLATE RECEPTOR-TARGETED RADIOTHERAPEUTIC AGENTS AND THEIR USE NOVARTIS PHARMACEUTICALS CORPORATION 2024-08-01 US disclosed
EP-4323017-A1 FOLATE RECEPTOR-TARGETED RADIOTHERAPEUTIC AGENTS AND THEIR USE Novartis AG (CH) 2024-02-21 EP disclosed
CN-117083088-A Folate receptor targeted radiotherapy agent and use thereof 诺华股份有限公司 2023-11-17 CN disclosed
EP-4097120-A1 ISOTOPICALLY LABELLED SELECTIVE CXCR4 BINDING PEPTIDE CONJUGATE AND METHODS FOR MAKING AND USING THE SAME Mainline Biosciences LLC (US) 2022-12-07 EP disclosed
WO-2022219569-A1 FOLATE RECEPTOR-TARGETED RADIOTHERAPEUTIC AGENTS AND THEIR USE NOVARTIS AG (CH) 2022-10-20 WO 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-20240252693-A1 FOLATE RECEPTOR-TARGETED RADIOTHERAPEUTIC AGENTS AND THEIR USE FOLR1, FOLR2, FOLH1 OPRD1 4084/4885NLN 3301/4885DPP4 4409/4885

“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.