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Sugi Predict / Compounds / SCHEMBL6012083

SCHEMBL6012083

SCHEMBL6012083

Bc1ccc(/C=C/C2CCN(C(=O)CN3CCNCC3)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 17/20 0.41
▸ WNT3 P56703 1/20 0.38
▸ SFRP1 Q8N474 1/20 0.38
▸ MAOA P21397 5/20 0.37
▸ KCNH2 Q12809 1/20 0.35

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
SCHEMBL6012082 0.88 MAOB (0.50) MAOBWNT3SFRP1
SCHEMBL10069270 0.88 MAOB (0.50) MAOB
SCHEMBL14261829 0.88 MAOB (0.50) MAOBWNT3SFRP1KCNH2
Hydrochloric Acid SCHEMBL2720583 0.87 MAOB (0.49) MAOBWNT3SFRP1
Hydrochloric Acid SCHEMBL2720581 0.87 MAOB (0.49) MAOBWNT3SFRP1
SCHEMBL6012010 0.86 TSHR (0.48) MAOBWNT3SFRP1
SCHEMBL27637238 0.81 WNT3 (0.40) MAOBWNT3SFRP1MAOAKCNH2
SCHEMBL6011019 0.80 ALDH1A1 (0.43) MAOBMAOA
SCHEMBL6011980 0.80 POLB (0.42) MAOBWNT3SFRP1MAOAKCNH2
SCHEMBL6011048 0.80 ALDH1A1 (0.47) MAOBWNT3SFRP1MAOAKCNH2

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
EP-1785415-B1 PIPERIDINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC (JP) 2012-05-02 — — EP disclosed
EP-1785415-A1 PIPERIDINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Astellas Pharma Inc. (JP) 2007-05-16 — — EP disclosed