SCHEMBL9124016

SCHEMBL9124016

C=Cc1ccc(C)c(Cl)c1Cl

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31

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
SCHEMBL7914829 0.84 ALDH1A1 (0.38) ALDH1A1
SCHEMBL3686691 0.79 ALDH1A1 (0.48) ALDH1A1
SCHEMBL8608699 0.76 ALDH1A1 (0.44) ALDH1A1PDE3BPDE3A
SCHEMBL29403294 0.76 CYP3A4 (0.41) ALDH1A1PDE3BPDE3A
SCHEMBL477584 0.76 CYP3A4 (0.41) ALDH1A1PDE3BPDE3A
SCHEMBL27389280 0.76 ALDH1A1 (0.36) ALDH1A1
SCHEMBL59762 0.75 ALDH1A1 (0.48) ALDH1A1
SCHEMBL24933437 0.73 ALDH1A1 (0.31) ALDH1A1
Water SCHEMBL28514557 0.73 CYP3A4 (0.39) ALDH1A1PDE3BPDE3A
SCHEMBL28418702 0.71 ALDH1A1 (0.39) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5380619-A Copolymer of acrylonitrile and chloromethylstyrene modified with trialkylphosphine, diffusion transfer AGFA-GEVAERT, N.V. (BE) 1995-01-10 US disclosed
EP-0295338-B1 PHOTOGRAPHIC ELEMENT CONTAINING A POLYMERIC PHOSPHONIOM MORDENT AGFA-GEVAERT N.V. (BE) 1991-09-11 EP disclosed
EP-0396113-A2 Grafted olefin copolymers and polycarbonate blends modified with a grafted olefin copolymer THE DOW CHEMICAL COMPANY (US) 1990-11-07 EP disclosed
EP-0295338-A1 Photographic element containing a polymeric phosphoniom mordent AGFA-GEVAERT N.V. (BE) 1988-12-21 EP disclosed
US-3969433-A ADDITION POLYMER KOSE AKIRA 1976-07-13 US disclosed