SCHEMBL30358484

SCHEMBL30358484

CC(C)CC(C)c1cc(Cc2cc(C(C)CC(C)C)c(N)c(C(C)CC(C)C)c2)cc(C(C)CC(C)C)c1N

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHFR P00374 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
SCHEMBL342170 0.81 TSHR (0.38) DHFR
SCHEMBL101727 0.78 DHFR (0.41) DHFR
SCHEMBL30358470 0.78 GAA (0.35) DHFR
Hydrochloric Acid SCHEMBL15287283 0.76 DHFR (0.40) DHFR
SCHEMBL30358474 0.75 BDKRB2 (0.31)
SCHEMBL9682126 0.72 AR (0.36) DHFR
SCHEMBL9456464 0.72 TSHR (0.43)
SCHEMBL10661127 0.72 POLB (0.37) DHFR
SCHEMBL3471927 0.69 POLB (0.34) DHFR
SCHEMBL3870609 0.69 DHFR (0.36) DHFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115960328-A Additives for 3D printing techniques 赢创运营有限公司 2023-04-14 CN disclosed