SCHEMBL178258

SCHEMBL178258

CC1=[N+](CCCCCC(=O)O)c2ccc(S(=O)(=O)O)cc2C1(C)CCCS(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.32
TBXA2R P21731 1/20 0.31
CYP26B1 Q9NR63 1/20 0.31
PKM P14618 1/20 0.31
ADRB2 P07550 1/20 0.31
HTR1A P08908 1/20 0.31
FOLH1 Q04609 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL12952231 0.97 ADRB2 (0.32) ALDH1A1TBXA2RCYP26B1PKMADRB2
SCHEMBL1656937 0.96 ADRB2 (0.33) ALDH1A1TBXA2RCYP26B1PKMADRB2
SCHEMBL559885 0.95 ADRB2 (0.33) ALDH1A1TBXA2RCYP26B1PKMADRB2
SCHEMBL559886 0.95 ADRB2 (0.33) ALDH1A1TBXA2RCYP26B1PKMADRB2
SCHEMBL11912398 0.94 ALDH1A1 (0.33) ALDH1A1TBXA2RCYP26B1PKMFOLH1
SCHEMBL3239947 0.93 ALDH1A1 (0.32) ALDH1A1CYP26B1
SCHEMBL15246873 0.91 ADRB2 (0.30) ADRB2HTR1AFOLH1
SCHEMBL9961373 0.91 PKM (0.33) CYP26B1PKMMAPK1
SCHEMBL15227488 0.90 ADRB2 (0.32) ALDH1A1TBXA2RCYP26B1PKMADRB2
SCHEMBL1715480 0.90 ADRB2 (0.32) ALDH1A1TBXA2RCYP26B1PKMADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11624089-B2 Cyanine dyes PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2023-04-11 US disclosed
US-11053222-B2 Fluorescent compounds PIERCE BIOTECHNOLOGY, INC. (US) 2021-07-06 US disclosed
US-20200232023-A1 CYANINE DYES PACIFIC BIOSCIENCES OF CALIFORNIA, INC. 2020-07-23 US disclosed
US-10696653-B2 Cyanine compounds PIERCE BIOTECHNOLOGY, INC. (US) 2020-06-30 US disclosed
US-10392659-B2 Cyanine dyes PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2019-08-27 US disclosed
US-10351551-B2 Fluorescent compounds PIERCE BIOTECHNOLOGY, INC. (US) 2019-07-16 US disclosed
EP-3081564-B1 INDOLE DERIVATIVES AS LABELING DYE FOR BIOMOLECULE PIERCE BIOTECHNOLOGY INC (US) 2019-07-10 EP disclosed
US-20180327387-A1 Cyanine Compounds PIERCE BIOTECHNOLOGY, INC. (US) 2018-11-15 US disclosed
US-10053447-B2 Fluorescent compounds PIERCE BIOTECHNOLOGY, INC (US) 2018-08-21 US disclosed
EP-3029027-B1 FLUORESCENT COMPOUNDS PIERCE BIOTECHNOLOGY INC (US) 2018-06-27 EP disclosed
EP-2655327-A1 FLUORESCENT COMPOUNDS Pierce Biotechnology, Inc. (US) 2013-10-30 EP disclosed
US-20130251637-A9 FLUORESCENT COMPOUNDS DYOMICS GMBH (DE) 2013-09-26 US disclosed
WO-2013130761-A1 INDOLE DERIVATIVES AS LABELING DYE FOR BIOMOLECULE PIERCE BIOTECHNOLOGY, INC. (US) 2013-09-06 WO disclosed
US-20130230466-A1 CYANINE COMPOUNDS HERMANSON GREG (US) 2013-09-05 US disclosed
US-20120294807-A9 FLUORESCENT COMPOUNDS DYOMICS GMBH (DE) 2012-11-22 US disclosed
WO-2012088007-A1 FLUORESCENT COMPOUNDS PIERCE BIOTECHNOLOGY, INC. (US) 2012-06-28 WO disclosed
US-20120156140-A1 FLUORESCENT COMPOUNDS DYOMICS GMBH (DE) 2012-06-21 US disclosed
US-20120058469-A1 FUNCTIONALIZED CYANINE DYES (PEG) PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2012-03-08 US disclosed
US-20120058482-A1 FUNCTIONALIZED CYANINE DYES (PEG) PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2012-03-08 US disclosed
US-20120052506-A1 CYANINE DYES PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2012-03-01 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 (14 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-10392659-B2 Cyanine dyes ABCG2, IK, ACR ALDH1A1 1447/4885TBXA2R 4739/4885CYP26B1 2082/4885
US-10351551-B2 Fluorescent compounds NCL, FUS, EFTUD2 ALDH1A1 2481/4885TBXA2R 3775/4885CYP26B1 4096/4885
US-11624089-B2 Cyanine dyes ABCG2, IK, ACR ALDH1A1 1447/4885TBXA2R 4739/4885CYP26B1 2082/4885
US-20180327387-A1 Cyanine Compounds NCL, NOP58, NAT10 ALDH1A1 3956/4885TBXA2R 4841/4885CYP26B1 4610/4885
US-20120156140-A1 FLUORESCENT COMPOUNDS NCL, FUS, EFTUD2 ALDH1A1 2481/4885TBXA2R 3775/4885CYP26B1 4096/4885
US-10696653-B2 Cyanine compounds NCL, NOP58, NAT10 ALDH1A1 3956/4885TBXA2R 4841/4885CYP26B1 4610/4885
US-20130230466-A1 CYANINE COMPOUNDS NCL, NOP58, NAT10 ALDH1A1 3956/4885TBXA2R 4841/4885CYP26B1 4610/4885
US-20120052506-A1 CYANINE DYES ABCG2, IK, ACR ALDH1A1 1447/4885TBXA2R 4739/4885CYP26B1 2082/4885
US-20200232023-A1 CYANINE DYES ABCG2, IK, ACR ALDH1A1 1447/4885TBXA2R 4739/4885CYP26B1 2082/4885
US-11053222-B2 Fluorescent compounds NCL, FUS, EFTUD2 ALDH1A1 2481/4885TBXA2R 3775/4885CYP26B1 4096/4885
US-20120058482-A1 FUNCTIONALIZED CYANINE DYES (PEG) ACR, IK, EGFR ALDH1A1 1508/4885TBXA2R 4718/4885CYP26B1 2387/4885
US-20130251637-A9 FLUORESCENT COMPOUNDS NCL, FUS, EFTUD2 ALDH1A1 2481/4885TBXA2R 3775/4885CYP26B1 4096/4885
US-10053447-B2 Fluorescent compounds NCL, FUS, EFTUD2 ALDH1A1 2481/4885TBXA2R 3775/4885CYP26B1 4096/4885
US-20120294807-A9 FLUORESCENT COMPOUNDS NCL, FUS, EFTUD2 ALDH1A1 2481/4885TBXA2R 3775/4885CYP26B1 4096/4885

“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.