SCHEMBL9317399

SCHEMBL9317399

C=CC(=O)OCCCCCCS(=O)(=O)c1ccc(/N=N/c2ccc(SC[C@H](C)CC)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.33
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 1/20 0.30
PLA2G2C Q5R387 1/20 0.30
THRA P10827 1/20 0.30
THRB P10828 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
SCHEMBL9317393 1.00 TSHR (0.35) TSHRALDH1A1CYP3A4HPGDCA1
SCHEMBL9317446 0.90 TSHR (0.36) TSHRALDH1A1CYP3A4HPGDPLA2G2C
SCHEMBL9317449 0.90 TSHR (0.36) TSHRALDH1A1CYP3A4HPGDPLA2G2C
SCHEMBL9317401 0.88 TSHR (0.36) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL9317395 0.88 TSHR (0.36) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL9317398 0.88 TSHR (0.36) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL9318824 0.84 ALDH1A1 (0.41) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL9318816 0.84 ALDH1A1 (0.41) TSHRALDH1A1CYP3A4HPGDCA2
SCHEMBL9317416 0.84 MMP1 (0.37) TSHRALDH1A1CYP3A4HPGDPLA2G2C
SCHEMBL9317422 0.84 MMP1 (0.37) TSHRALDH1A1CYP3A4HPGDPLA2G2C

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-5322986-A Methods for preparing polymer stripe waveguides and polymer stripe waveguides prepared thereby EASTMAN KODAK COMPANY (US) 1994-06-21 US disclosed
US-5157541-A Support with dielectric, reflection metal, polymeric electrooptical layers, couterelectrode EASTMAN KODAK COMPANY (US) 1992-10-20 US disclosed
US-5075796-A OPTICAL ARTICLE FOR MULTICOLOR IMAGING EASTMAN KODAK COMPANY (US) 1991-12-24 US disclosed
EP-0422725-A2 High x(2) optical article EASTMAN KODAK COMPANY (US) 1991-04-17 EP disclosed
EP-0422723-A2 Optical article for reflection modulation EASTMAN KODAK COMPANY (US) 1991-04-17 EP disclosed
US-4948225-A REFLECTIVE METAL LAYER, DIELECTRICS, PROTECTIVE COATING EASTMAN KODAK COMPANY (US) 1990-08-14 US disclosed