SCHEMBL30880905

SCHEMBL30880905

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CXCR4 P61073 3/20 0.63
▸ NPY1R P25929 1/20 0.62
▸ NPY2R P49146 1/20 0.62
▸ NPY4R P50391 1/20 0.62
▸ NPY5R Q15761 1/20 0.62
▸ GLP1R P43220 8/20 0.58
▸ C5AR1 P21730 1/20 0.58
▸ CTSL P07711 2/20 0.57
▸ CTSS P25774 2/20 0.57
▸ CTSK P43235 2/20 0.57
▸ IL23R Q5VWK5 1/20 0.56
▸ CTSH P09668 1/20 0.56
▸ RXFP1 Q9HBX9 1/20 0.56
▸ GIPR P48546 4/20 0.56
▸ GCGR P47871 2/20 0.56

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
SCHEMBL30578735 0.93 NPY2R (0.64) CXCR4NPY1RNPY2RNPY4RNPY5R
SCHEMBL30578728 0.92 CXCR4 (0.66) CXCR4NPY1RNPY2RNPY4RNPY5R
SCHEMBL9073974 0.88 CXCR4 (0.72) CXCR4NPY1RNPY2RNPY4RNPY5R
SCHEMBL29430205 0.88 NPY1R (0.65) CXCR4NPY1RNPY2RNPY4RNPY5R
SCHEMBL29624137 0.88 CXCR4 (0.65) CXCR4NPY1RNPY2RNPY4RNPY5R
SCHEMBL30816280 0.88 NPY1R (0.65) CXCR4NPY1RNPY2RNPY4RNPY5R
Cecropin A SCHEMBL29361111 0.86 KEAP1 (0.67) NPY1RNPY2RNPY4RNPY5RGLP1R
SCHEMBL30880883 0.86 NPY1R (0.61) CXCR4NPY1RNPY2RNPY4RNPY5R
SCHEMBL30261957 0.86 C5AR1 (0.68) CXCR4NPY1RNPY2RNPY4RNPY5R
SCHEMBL28271119 0.86 CXCR4 (0.63) CXCR4NPY1RNPY2RNPY4RNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12570729-B2 Antibody fragment based antifungal conjugate selectively targeting candida ABGENICS LIFESCIENCES PRIVATE LIMITED (IN) 2026-03-10 — — US disclosed
US-20240092878-A1 AN ANTIBODY FRAGMENT BASED ANTIFUNGAL CONJUGATE SELECTIVELY TARGETING CANDIDA ABGENICS LIFESCIENCES PRIVATE LIMITED (IN) 2024-03-21 — — 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-12570729-B2 Antibody fragment based antifungal conjugate selectively targeting candida SERPINH1, HM13, NGLY1 CXCR4 2906/4885NPY1R 3197/4885NPY2R 4335/4885

“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.

Send feedback