Sugi Predict

Sugi Predict / Compounds / SCHEMBL5290964

SCHEMBL5290964

SCHEMBL5290964

CCCN1C=CN(c2ccccc2)C1Cc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ KCNH2 Q12809 1/20 0.35
▸ CES2 O00748 2/20 0.35
▸ CARM1 Q86X55 1/20 0.33
▸ PRMT6 Q96LA8 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ATM Q13315 1/20 0.33

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
SCHEMBL5282404 0.91 KCNH2 (0.40) KCNH2
SCHEMBL5288382 0.90 KCNH2 (0.45) KCNH2
SCHEMBL5302065 0.88 KCNH2 (0.47) KCNH2
SCHEMBL5816763 0.88 KCNH2 (0.47) KCNH2
SCHEMBL5289434 0.88 KCNH2 (0.47) KCNH2
SCHEMBL5289950 0.88 KCNH2 (0.47) KCNH2
SCHEMBL5307999 0.88 KCNH2 (0.47) KCNH2
SCHEMBL5328123 0.88 KCNH2 (0.47) KCNH2
SCHEMBL5292770 0.88 KCNH2 (0.47) KCNH2
SCHEMBL5816265 0.88 KCNH2 (0.47) KCNH2

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-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 — — WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 — — WO disclosed