SCHEMBL21044901

SCHEMBL21044901

C1=CCC(C(C2=CC=CC2)c2ccccc2)=C1.Cl[Zr]

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
SLC6A2 P23975 3/20 0.33
SLC6A4 P31645 3/20 0.33
SLC6A3 Q01959 3/20 0.33
TSHR P16473 1/20 0.33
CYP2D6 P10635 1/20 0.31
CFTR P13569 1/20 0.31
GOPC Q9HD26 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
CRHBP P24387 1/20 0.30
CRHR2 Q13324 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
SCHEMBL7719567 0.94 SLC6A3 (0.37) GAASLC6A2SLC6A4SLC6A3TSHR
Hydrochloric Acid SCHEMBL8677321 0.90 SLC6A2 (0.34) GAASLC6A2SLC6A4SLC6A3TSHR
Hydrochloric Acid SCHEMBL8677325 0.90 SLC6A2 (0.39) GAASLC6A2SLC6A4SLC6A3TSHR
SCHEMBL28838088 0.90 SLC6A3 (0.37) GAASLC6A2SLC6A4SLC6A3TSHR
SCHEMBL8976258 0.76 CHRNA7 (0.35) GAAMEN1MAPTKMT2A
SCHEMBL9302592 0.76 TYR (0.39) GAACYP2D6KDM4EMEN1KMT2A
SCHEMBL12846240 0.74 DPP4 (0.39) TSHRCYP2D6KDM4E
SCHEMBL11066697 0.74 MEN1 (0.41) TSHRKDM4EMEN1MAPTKMT2A
SCHEMBL20913264 0.72 CHRNA7 (0.35) GAAMEN1MAPTKMT2A
SCHEMBL19052338 0.71 SLC6A2 (0.34) GAASLC6A2SLC6A4SLC6A3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3492982-B1 PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, LAMINATE, METHOD FOR PRODUCING CURED FILM, METHOD FOR PRODUCING LAMINATE, AND SEMICONDUCTOR DEVICE FUJIFILM CORP (JP) 2020-11-11 EP disclosed
EP-3492982-A1 PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, LAMINATE, METHOD FOR PRODUCING CURED FILM, METHOD FOR PRODUCING LAMINATE, AND SEMICONDUCTOR DEVICE FUJIFILM Corporation (JP) 2019-06-05 EP disclosed