SCHEMBL6568247

SCHEMBL6568247

COc1ccc2sc(C(=O)Nc3nnn[nH]3)c(Oc3ccccc3)c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.51
CYSLTR1 Q9Y271 1/20 0.51
ICAM1 P05362 2/20 0.45
SELE P16581 2/20 0.45
BTK Q06187 1/20 0.41
VCAM1 P19320 1/20 0.40
PGR P06401 1/20 0.38
SCD O00767 2/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
SENP5 Q96HI0 2/20 0.37
SENP2 Q9HC62 2/20 0.37
SENP1 Q9P0U3 2/20 0.37
PRSS12 P56730 1/20 0.37
KMT2A Q03164 2/20 0.36

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
SCHEMBL9247854 0.92 MPO (0.42) MPOCYSLTR1BTKPGRSCD
SCHEMBL9247114 0.90 MPO (0.56) MPOCYSLTR1ICAM1SELEVCAM1
SCHEMBL6292164 0.89 NUDT1 (0.42) MPOCYSLTR1BTKNPC1RAB9A
SCHEMBL6568264 0.88 SENP5 (0.49) MPOCYSLTR1ICAM1SELESCD
SCHEMBL9371455 0.87 MPO (0.57) MPOCYSLTR1ICAM1SELEBTK
SCHEMBL10372978 0.86 MPO (0.52) MPOCYSLTR1ICAM1SELEVCAM1
SCHEMBL6440669 0.85 MPO (0.69) MPOCYSLTR1ICAM1SELEVCAM1
SCHEMBL10371017 0.85 MPO (0.52) MPOCYSLTR1ICAM1SELEVCAM1
SCHEMBL8767124 0.84 MPO (0.68) MPOCYSLTR1ICAM1SELEVCAM1
SCHEMBL6811772 0.83 EDNRA (0.48) MPOCYSLTR1ICAM1SELESCD

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6471997-B1 ANTAGONIST OF CALCITONIN GENE RELATED PEPTIDE, CGRP AND/OR OF SUBSTANCE P; COSMETIC SOCIETE L'OREAL S.A. (FR) 2002-10-29 US claimed
US-5993833-A Histamine antagonist, an interleukin-1 antagonist and/or a TNF alpha antagonist in a cosmetic, pharmaceutical or dermatological composition SOCIETE L'OREAL S.A. (FR) 1999-11-30 US claimed
EP-0765668-B1 Extract of Iridaceas and compositions containing it OREAL (FR) 1999-03-17 EP claimed
US-5795574-A COSMETICS WITH SUBSTANCE P ANTAGONIST SOCIETE L'OREAL S.A. (FR) 1998-08-18 US claimed
EP-0761204-B1 Use of extracts of filamentous, non photosynthetic bacteria and the composition containing them OREAL (FR) 1998-04-15 EP claimed
EP-0765668-A1 Extract of Iridaceas and composition containing it L'OREAL (FR) 1997-04-02 EP claimed
WO-1997009032-A1 UTILIZATION OF AN EXTRACT OF A NON PHOTOSYNTHETIC FILAMENTARY BACTERIUM AND COMPOSITION CONTAINING SUCH EXTRACT L'OREAL (FR) 1997-03-13 WO claimed
WO-1997009056-A1 EXTRACT OF IRIDACEAE AND COMPOSITIONS CONTAINING SUCH EXTRACT L'OREAL (FR) 1997-03-13 WO claimed
EP-0761204-A1 Use of extracts of filamentous, non photosynthetic bacteria and the composition containing them L'OREAL (FR) 1997-03-12 EP claimed
EP-0299457-B1 Novel benzothiophenes having antiallergic activity and both novel and other selected benzothiophenes having activity for treating acute respiratory distress syndrome WARNER LAMBERT CO (US) 1994-09-21 EP claimed
US-4910317-A Containing a 5-amidetetrazole substitution in position 2 WARNER-LAMBERT COMPANY (US) 1990-03-20 US claimed
JP-1110682-A None JP disclosed
EP-1491183-A2 Use of a plant extract of the Rosaceae family L'OREAL (FR) 2004-12-29 EP disclosed
EP-0729750-B1 Alpha-TNF antagonists in a cosmetic, pharmaceutical or dermatological composition. OREAL (FR) 2004-03-24 EP disclosed
US-20010022978-A1 Cosmetic, pharmaceutical or dermatological composition comprising a histamine antagonist, an interleukin-1 antagonist and/or a TNF-alpha antagonist LACHARRIERE OLIVIER DE (FR) 2001-09-20 US disclosed
EP-0729750-A1 Use of an interleukin-1 antagonist and/or alpha-TNF antagonist in a cosmetic, pharmaceutical or dermatological composition, and the composition therefrom, possibly used in combination with a histamine antagonist L'OREAL (FR) 1996-09-04 EP disclosed
US-5426113-A Administering for inhibition of neutrophil adhesion WARNER-LAMBERT COMPANY (US) 1995-06-20 US disclosed
US-4931459-A ADMINISTERING SUBSTITUTED BENZOTHIOPHENES OR BENZOFURANS WARNER-LAMBERT COMPANY (US) 1990-06-05 US disclosed
US-4910317-A Containing a 5-amidetetrazole substitution in position 2 WARNER-LAMBERT COMPANY (US) 1990-03-20 US disclosed
JP-H01110682-A NEW BENZOTHIOPHENE HAVING ANTIALLERGIC ACTIVITY WARNER LAMBERT CO 1989-04-27 JP 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-20010022978-A1 Cosmetic, pharmaceutical or dermatological composition comprising a histamine antagonist, an interleukin-1 antagonist and/or a TNF-alpha antagonist TNF, IL1A, IL1B MPO 442/4885CYSLTR1 33/4885ICAM1 43/4885

“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.