SCHEMBL9528772

SCHEMBL9528772

[C]1c2cc3ccccc3cc2CCC1C1CCCc2cc3ccccc3cc21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.32
ALOX15 P16050 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
SCHEMBL1970744 0.74 IDO1 (0.41)
SCHEMBL19803966 0.71 IGF1R (0.39) IGF1RALOX15
SCHEMBL5256851 0.70 PDPK1 (0.39)
SCHEMBL10876535 0.68 IGF1R (0.37) IGF1RALOX15
SCHEMBL6811001 0.67 IGF1R (0.42) IGF1RALOX15
SCHEMBL7765637 0.67 IGF1R (0.39) IGF1RALOX15
SCHEMBL1941577 0.67 IGF1R (0.39) IGF1RALOX15
SCHEMBL1941083 0.67 IGF1R (0.39) IGF1RALOX15
SCHEMBL4904876 0.66 SIGMAR1 (0.43)
SCHEMBL121704 0.65 PDPK1 (0.43)

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
EP-0301751-B1 PYRIDINIUM DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1993-03-10 EP disclosed