SCHEMBL3096478

SCHEMBL3096478

COC(=O)Cc1ccc2c(c1)N(S(=O)(=O)c1ccccc1C(F)(F)F)CCC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
LMNA P02545 4/20 0.44
PKM P14618 1/20 0.44
CPT1A P50416 3/20 0.44
CPT1B Q92523 3/20 0.44
ALDH1A1 P00352 3/20 0.44
KMT2A Q03164 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
CPT2 P23786 1/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 1/20 0.44
RORC P51449 3/20 0.43
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
TSHR P16473 2/20 0.42
MCOLN3 Q8TDD5 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
SCHEMBL3082913 0.88 CPT1A (0.49) POLBRXFP1LMNAPKMCPT1A
SCHEMBL3101933 0.84 ALDH1A1 (0.47) POLBLMNACPT1ACPT1BALDH1A1
SCHEMBL3088755 0.79 CPT1A (0.49) CPT1ACPT1BCPT2RORCTSHR
SCHEMBL18601034 0.77 KMT2A (0.60) KMT2ACNR1CNR2MEN1CRHBP
SCHEMBL3091055 0.76 L3MBTL1 (0.48) CPT1ACPT1BALDH1A1KMT2ASMN1; SMN2
SCHEMBL3102258 0.76 LMNA (0.46) POLBRXFP1LMNAPKMALDH1A1
SCHEMBL3096475 0.76 CPT1A (0.44) CPT1ACPT1BALDH1A1KMT2ACPT2
SCHEMBL3095912 0.74 LMNA (0.43) POLBRXFP1LMNAPKMALDH1A1
SCHEMBL3089857 0.74 CPT1A (0.44) CPT1ACPT1BALDH1A1KMT2ASMN1; SMN2
SCHEMBL3084305 0.71 CPT1A (0.49) CPT1ACPT1BALDH1A1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2393812-B1 SUBSTITUTED SPIROAMIDES AS B1R-MODULATORS GRUENENTHAL GMBH (DE) 2013-07-03 EP disclosed
US-8357717-B2 Spiro group-containing amide compounds having bradykinin 1 receptor (B1R) activity GRUENENTHAL GMBH (DE) 2013-01-22 US disclosed
US-8357717-B2 Spiro group-containing amide compounds having bradykinin 1 receptor (B1R) activity GRUENENTHAL GMBH (DE) 2013-01-22 US disclosed
US-8357717-B2 Spiro group-containing amide compounds having bradykinin 1 receptor (B1R) activity GRUENENTHAL GMBH (DE) 2013-01-22 US disclosed
US-20100234340-A1 Substituted Spiroamide Compounds GRUENENTHAL GMBH (DE) 2010-09-16 US disclosed
US-20100234340-A1 Substituted Spiroamide Compounds GRUENENTHAL GMBH (DE) 2010-09-16 US disclosed
US-20100234340-A1 Substituted Spiroamide Compounds GRUENENTHAL GMBH (DE) 2010-09-16 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 (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-20100234340-A1 Substituted Spiroamide Compounds BDKRB1, BDKRB2, AVPR1B POLB 3022/4885RXFP1 156/4885LMNA 553/4885

“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.