SCHEMBL134567

SCHEMBL134567

CC1=[N+](CCCS(=O)(=O)[O-])c2ccc(CN3C(=O)c4ccccc4C3=O)cc2C1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
MAPT P10636 3/20 0.39
HTT P42858 2/20 0.39
HPGD P15428 2/20 0.39
PABPC1 P11940 1/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
CLTC Q00610 2/20 0.38
KMT2A Q03164 4/20 0.36
CASP3 P42574 3/20 0.36
PKM P14618 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RECQL P46063 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL178274 0.90 ALOX15 (0.39) CA12CA1CA2CA9MAPT
SCHEMBL5697898 0.87 ALOX15 (0.38) CA12CA1CA2CA9MAPT
SCHEMBL12901060 0.82 HPGD (0.41) CA12CA1CA2CA9MAPT
SCHEMBL135279 0.81 MEN1 (0.38) CA12CA1CA2CA9MAPT
Perchlorate SCHEMBL2057262 0.81 HPGD (0.39) CA12CA1CA2CA9MAPT
SCHEMBL2057331 0.78 ALOX15 (0.46) CA12CA1CA2CA9MAPT
SCHEMBL136667 0.78 ALDH1A1 (0.43) MAPTHTTHPGDPABPC1KMT2A
SCHEMBL13984987 0.77 HPGD (0.36) CA12CA1CA2CA9MAPT
Bromide SCHEMBL6537326 0.75 MAPK1 (0.38) MAPK1PKMALDH1A1GAA
SCHEMBL634270 0.75 MAPT (0.42) MAPTHTTHPGDPABPC1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9920365-B2 Functionalized cyanine dyes (PEG) PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2018-03-20 US disclosed
US-20150344950-A1 Functionalized Cyanine Dyes (PEG) PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2015-12-03 US disclosed
US-9051263-B2 Functionalized cyanine dyes (PEG) PACIFIC BIOSCIENCES OF CALIFORNIA, INC. (US) 2015-06-09 US disclosed
US-8669374-B2 Functionalized cyanine dyes (PEG) PACIFIC BIOSCIENCES OF CALIFORNIA, INC. 2014-03-11 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

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-20120058482-A1 FUNCTIONALIZED CYANINE DYES (PEG) ACR, IK, EGFR CA12 127/4885CA1 1422/4885CA2 2294/4885

“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.