Sugi Predict

Sugi Predict / Compounds / SCHEMBL11289304

SCHEMBL11289304

SCHEMBL11289304

CCN(c1cccc2ccccc12)C1CC2(CCCCC2)Oc2ccc(OC)cc21

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 17/20 0.44
▸ IDO1 P14902 1/20 0.36
▸ TP53 P04637 1/20 0.34
▸ EDNRA P25101 1/20 0.34

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
SCHEMBL11277101 0.94 C5AR1 (0.42) C5AR1IDO1
SCHEMBL11275302 0.86 C5AR1 (0.40) C5AR1
SCHEMBL11277198 0.86 C5AR1 (0.42) C5AR1TP53
SCHEMBL11286697 0.85 C5AR1 (0.40) C5AR1
SCHEMBL11481320 0.85 IDO1 (0.36) IDO1TP53
SCHEMBL11282317 0.84 C5AR1 (0.51) C5AR1
SCHEMBL11279459 0.82 C5AR1 (0.40) C5AR1
SCHEMBL11292485 0.80 C5AR1 (0.47) C5AR1
SCHEMBL11478565 0.79 MAPT (0.38) IDO1
SCHEMBL11289402 0.79 C5AR1 (0.43) C5AR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0001428-B1 INSECTICIDAL AND ACARICIDAL AGENTS CONTAINING CHROMAN DERIVATIVES, THEIR PREPARATION AND THEIR USE, AS WELL AS CHROMAN DERIVATIVES AND THEIR PREPARATION BAYER AG (DE) 1982-03-24 — — EP disclosed
US-4238501-A INSECTICIDES, MITICIDES, PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-12-09 — — US disclosed
US-4237162-A MITICIDES, LARVACIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-12-02 — — US disclosed