SCHEMBL6536908

SCHEMBL6536908

CCCNC(=O)CCSSCCC(=O)NCCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
CASP2 P42575 1/20 0.47
MCL1 Q07820 1/20 0.47
CNR1 P21554 1/20 0.44
NAAA Q02083 1/20 0.44
HPGD P15428 1/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
FAAH O00519 4/20 0.42
KMT2A Q03164 2/20 0.40
DNM1 Q05193 2/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP3 P08254 1/20 0.40
MMP9 P14780 1/20 0.40
MEN1 O00255 1/20 0.39
CTSD P07339 1/20 0.39

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
SCHEMBL10000782 0.90 LMNA (0.43) LMNACASP2MCL1CNR1NAAA
SCHEMBL12523062 0.87 CASP2 (0.59) LMNACASP2CNR1NAAAHPGD
SCHEMBL9518772 0.85 CASP2 (0.68) CASP2NAAAHPGDFAAHKMT2A
SCHEMBL7134927 0.84 CASP2 (0.45) CASP2MCL1CNR1NAAAHPGD
SCHEMBL9518701 0.84 CASP2 (0.71) CASP2NAAAFAAHDNM1EPHX1
SCHEMBL9502450 0.84 CASP2 (0.71) CASP2NAAAFAAHDNM1EPHX1
SCHEMBL2616294 0.84 CASP2 (0.55) LMNACASP2CNR1NAAAHPGD
SCHEMBL1146790 0.84 CASP2 (0.71) CASP2NAAAFAAHDNM1EPHX1
SCHEMBL3351989 0.83 CASP2 (0.56) CASP2MCL1CNR1NAAAFAAH
SCHEMBL12312998 0.83 CASP2 (0.44) CASP2MCL1CNR1NAAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6696234-B2 Silver halide photosensitive material and isothiazolidine-3-one derivative FUJI PHOTO FILM CO., LTD. (JP) 2004-02-24 US disclosed
US-20030190566-A1 Silver halide photosensitive material and isothiazolidine-3-one derivative FUJI PHOTO FILM CO., LTD. 2003-10-09 US disclosed
US-5008395-A Forming hydrochloride salt, removing excess hydrogen chloride, cooling until crystals form, ripening, filtering ROHM AND HAAS COMPANY (US) 1991-04-16 US disclosed
EP-0375265-A2 Purification of isothiazolones ROHM AND HAAS COMPANY (US) 1990-06-27 EP 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-20030190566-A1 Silver halide photosensitive material and isothiazolidine-3-one derivative NRP1, NR2E3, SCN1B LMNA 4737/4885CASP2 2309/4885MCL1 385/4885

“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.