SCHEMBL17150138

SCHEMBL17150138

C=CC(=C)NCNC(=C)C=C

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ TP53 P04637 1/20 0.32

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
SCHEMBL18100117 0.85 — —
SCHEMBL12826433 0.84 ALDH1A1 (0.76) ALDH1A1TSHRMAPK1TDP1
SCHEMBL19882682 0.83 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1TDP1
SCHEMBL15871616 0.78 — —
SCHEMBL24937031 0.75 — —
SCHEMBL17209851 0.75 — —
SCHEMBL18100122 0.75 — —
SCHEMBL20620306 0.75 — —
SCHEMBL23992894 0.75 — —
SCHEMBL18744885 0.75 — —

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
WO-2021178601-A1 CROSSLINKED HYDROGEL COMPOSITIONS, METHODS OF MAKING SAME, AND USES THEREOF THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2021-09-10 — — WO disclosed
WO-2015153403-A1 SILICONE ACRYLAMIDE COPOLYMER JOHNSON & JOHNSON VISION CARE, INC. (US) 2015-10-08 — — WO disclosed
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