SCHEMBL12984633

SCHEMBL12984633

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 2/20 0.49
▸ RAMP3 O60896 8/20 0.47
▸ CALCR P30988 8/20 0.47
▸ KDM1A O60341 1/20 0.45
▸ MAOB P27338 1/20 0.45
▸ KDM5A P29375 1/20 0.45
▸ KDM1B Q8NB78 1/20 0.45
▸ GLP1R P43220 6/20 0.45
▸ GCGR P47871 5/20 0.45
▸ GIPR P48546 5/20 0.45
▸ F2 P00734 1/20 0.44
▸ PLG P00747 1/20 0.44
▸ PRSS1 P07477 1/20 0.44
▸ PRSS2 P07478 1/20 0.44
▸ PRSS3 P35030 1/20 0.44
▸ TPSAB1 Q15661 1/20 0.44
▸ PIN1 Q13526 1/20 0.44

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
SCHEMBL10066201 0.86 PRSS1 (0.49) APLNRRAMP3CALCRF2PLG
SCHEMBL10065813 0.85 PRSS1 (0.47) APLNRF2PLGPRSS1PRSS2
SCHEMBL10065714 0.79 PRSS1 (0.50) RAMP3CALCRF2PLGPRSS1
SCHEMBL12984646 0.76 RAMP3 (0.63) APLNRRAMP3CALCRPIN1
SCHEMBL24601727 0.76 GLP1R (0.60) GLP1RGCGRGIPR
SCHEMBL26346380 0.76 GLP1R (0.60) GLP1RGCGRGIPR
SCHEMBL22550671 0.75 RAMP3 (0.53) RAMP3CALCRKDM1AMAOBKDM5A
SCHEMBL24601539 0.75 F2 (0.50) GLP1RGCGRGIPRF2PLG
SCHEMBL10066227 0.75 CAPN1 (0.46) CALCR
SCHEMBL12985549 0.74 CAPN1 (0.46) CALCRF2

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-20100316563-A1 Method For The Preparation Of New Oligoclonal Antibodies BRACCO IMAGING S.P.A. (IT) 2010-12-16 — — US disclosed
US-20100316563-A1 Method For The Preparation Of New Oligoclonal Antibodies BRACCO IMAGING S.P.A. (IT) 2010-12-16 — — 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 (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-20100316563-A1 Method For The Preparation Of New Oligoclonal Antibodies APOB, APOL1, FCGR3B APLNR 443/4885RAMP3 3589/4885CALCR 1054/4885

“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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