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Sugi Predict / Compounds / SCHEMBL6007909

SCHEMBL6007909

SCHEMBL6007909

NC(Cc1ccc(Cl)cc1)CN1CCC(C(=O)c2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 7/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ HTR2A P28223 1/20 0.52
▸ KCNH2 Q12809 2/20 0.50
▸ DRD2 P14416 1/20 0.46
▸ DRD4 P21917 1/20 0.46
▸ DRD3 P35462 1/20 0.46

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
SCHEMBL6009245 0.95 MGLL (0.54) MGLLMEN1KMT2AHTR2AKCNH2
SCHEMBL6007356 0.92 HTR2A (0.61) MEN1KMT2AHTR2AKCNH2
SCHEMBL6009253 0.88 KCNH2 (0.55) MGLLMEN1KMT2AHTR2AKCNH2
SCHEMBL6007347 0.86 MGLL (0.59) MGLLMEN1KMT2AKCNH2DRD2
SCHEMBL6009242 0.85 MEN1 (0.57) MEN1KMT2AHTR2AKCNH2
SCHEMBL6009354 0.85 KCNH2 (0.61) MGLLMEN1KMT2AKCNH2
SCHEMBL3838690 0.84 HTR2A (0.61) HTR2A
SCHEMBL3838692 0.84 HTR2A (0.61) HTR2A
SCHEMBL3838687 0.84 HTR2A (0.61) HTR2A
SCHEMBL6007910 0.83 KCNH2 (0.50) HTR2AKCNH2

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
US-7078537-B2 Phenylalkyl diamine and amide analogs SK CORPORATION (KR) 2006-07-18 — — US claimed
US-7078537-B2 Phenylalkyl diamine and amide analogs SK CORPORATION (KR) 2006-07-18 — — US disclosed