SCHEMBL19976535

SCHEMBL19976535

CC1(C)C(/C=C/Nc2ccccc2)=[N+](CCCS(=O)(=O)O)c2ccc(C(=O)O)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
LMNA P02545 3/20 0.40
HTT P42858 3/20 0.40
MMP14 P50281 1/20 0.40
PTPN1 P18031 1/20 0.39
MAPT P10636 5/20 0.35
POLB P06746 4/20 0.35
THRB P10828 4/20 0.35
RAB9A P51151 4/20 0.35
NPC1 O15118 3/20 0.35
S1PR4 O95977 2/20 0.35
ALDH1A1 P00352 2/20 0.35
ALPG P10696 2/20 0.35
PKM P14618 2/20 0.35
S1PR1 P21453 2/20 0.35
NTSR1 P30989 2/20 0.35
KDM4E B2RXH2 2/20 0.35
XBP1 P17861 2/20 0.35
ALOX12 P18054 2/20 0.35

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
SCHEMBL14823547 0.94 PTPN1 (0.41) MEN1KMT2ALMNAHTTMMP14
SCHEMBL135730 0.92 MEN1 (0.42) MEN1KMT2ALMNAHTTMMP14
SCHEMBL10111563 0.88 MEN1 (0.52) MEN1KMT2ALMNAHTTMMP14
SCHEMBL13567272 0.88 MEN1 (0.43) MEN1KMT2ALMNAHTTMMP14
SCHEMBL1656266 0.88 MEN1 (0.43) MEN1KMT2ALMNAHTTMMP14
SCHEMBL3901072 0.87 MEN1 (0.42) MEN1KMT2ALMNAHTTMMP14
SCHEMBL3901075 0.87 MEN1 (0.42) MEN1KMT2ALMNAHTTMMP14
SCHEMBL3901077 0.87 MEN1 (0.42) MEN1KMT2ALMNAHTTMMP14
SCHEMBL136048 0.85 MEN1 (0.39) MEN1KMT2ALMNAHTTMMP14
SCHEMBL14812066 0.85 MEN1 (0.39) MEN1KMT2ALMNAHTTMMP14

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 3 patents. 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-20200232023-A1 CYANINE DYES PACIFIC BIOSCIENCES OF CALIFORNIA, INC. 2020-07-23 US disclosed
US-9920365-B2 Functionalized cyanine dyes (PEG) PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2018-03-20 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 (2 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-11624089-B2 Cyanine dyes ABCG2, IK, ACR MEN1 2288/4885KMT2A 2564/4885LMNA 1823/4885
US-20200232023-A1 CYANINE DYES ABCG2, IK, ACR MEN1 2288/4885KMT2A 2564/4885LMNA 1823/4885

“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.