Indocyanine Green Acid Form

Indocyanine Green Acid Form

SCHEMBL15929439

CC1(C)C(/C=C/C=C/C=C/C=C2/N(CCCCS(=O)(=O)O)c3ccc4ccccc4c3C2(C)C)=[N+](CCCCS(=O)(=O)O)c2ccc3ccccc3c21

nearest known ligand 0.93

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLNR O43193 1/20 0.93
NR1I2 O75469 1/20 0.93
PGR P06401 1/20 0.93
ADRB1 P08588 1/20 0.93
ADORA3 P0DMS8 1/20 0.93
CHRM1 P11229 1/20 0.93
DRD2 P14416 1/20 0.93
ADRA2B P18089 1/20 0.93
ADRA2C P18825 1/20 0.93
CHRM3 P20309 1/20 0.93
CNR1 P21554 1/20 0.93
DRD1 P21728 1/20 0.93
TBXA2R P21731 1/20 0.93
SLC6A2 P23975 1/20 0.93
HRH2 P25021 1/20 0.93
HTR2C P28335 1/20 0.93
BDKRB2 P30411 1/20 0.93
ADORA1 P30542 1/20 0.93
AGTR1 P30556 1/20 0.93
SLC6A4 P31645 1/20 0.93

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
Indocyanine Green Acid Form SCHEMBL9976691 1.00 MLNR (0.93) MLNRNR1I2PGRADRB1ADORA3
Indocyanine Green Acid Form SCHEMBL29714259 1.00 MLNR (0.93) MLNRNR1I2PGRADRB1ADORA3
SCHEMBL13127982 1.00 MLNR (0.93) MLNRNR1I2PGRADRB1ADORA3
Indocyanine Green Acid Form SCHEMBL30735698 1.00 MLNR (0.93) MLNRNR1I2PGRADRB1ADORA3
Indocyanine Green Acid Form SCHEMBL12891571 1.00 MLNR (0.93) MLNRNR1I2PGRADRB1ADORA3
SCHEMBL15182433 1.00 MLNR (0.93) MLNRNR1I2PGRADRB1ADORA3
Indocyanine Green Acid Form SCHEMBL14198523 1.00 MLNR (0.93) MLNRNR1I2PGRADRB1ADORA3
Indocyanine Green Acid Form SCHEMBL1783237 0.99 MLNR (0.91) MLNRNR1I2PGRADRB1ADORA3
Indocyanine Green Acid Form SCHEMBL10626491 0.99 MLNR (0.91) MLNRNR1I2PGRADRB1ADORA3
Indocyanine Green Acid Form SCHEMBL1783239 0.99 MLNR (0.91) MLNRNR1I2PGRADRB1ADORA3

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
US-11828752-B2 Protease-activated contrast agents for in vivo imaging THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2023-11-28 US disclosed
US-10022459-B2 Medical tissue-marker and manufacturing method for the same NATIONAL UNIVERSITY CORPORATION CHIBA UNIVERSITY (JP) 2018-07-17 US disclosed
WO-2018119476-A1 ACTIVITY-BASED PROBE COMPOUNDS, COMPOSITIONS, AND METHODS OF USE THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2018-06-28 WO disclosed
US-9920087-B2 Dithiolene metal complex colorless IR absorbers BASF SE (DE) 2018-03-20 US disclosed
US-9890187-B2 Prototype systems of theranostic biomarkers for in vivo molecular management of cancer EPOS-IASIS RESEARCH AND DEVELOPMENT, LTD. (CY) 2018-02-13 US disclosed
US-20170333575-A1 POLYMER AND CONTRAST AGENT FOR PHOTOACOUSTIC IMAGING INCLUDING THE POLYMER CANON KABUSHIKI KAISHA (JP) 2017-11-23 US disclosed
US-20140219924-A1 MEDICAL TISSUE-MARKER AND MANUFACTURING METHOD FOR THE SAME NATIONAL UNIVERSITY CORPORATION CHIBA UNIVERSITY (JP) 2014-08-07 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 (4 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-20170333575-A1 POLYMER AND CONTRAST AGENT FOR PHOTOACOUSTIC IMAGING INCLUDING THE POLYMER PHOSPHO1, PCTP, PAICS MLNR 1534/4885NR1I2 2522/4885PGR 2181/4885
US-20140219924-A1 MEDICAL TISSUE-MARKER AND MANUFACTURING METHOD FOR THE SAME CD63, CD68, PLIN5 MLNR 3607/4885NR1I2 2245/4885PGR 1220/4885
US-10022459-B2 Medical tissue-marker and manufacturing method for the same CD63, CD68, PLIN5 MLNR 3762/4885NR1I2 2608/4885PGR 1187/4885
US-11828752-B2 Protease-activated contrast agents for in vivo imaging CTSV, CTSF, CTSS MLNR 1410/4885NR1I2 4023/4885PGR 4472/4885

“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.