SCHEMBL9326409

SCHEMBL9326409

CCN(CCCCc1ccc(N)cc1)C(C)Cc1cccs1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 2/20 0.39
▸ MAOB P27338 2/20 0.38
▸ TAAR1 Q96RJ0 1/20 0.38
▸ TRPM8 Q7Z2W7 3/20 0.37
▸ KMT2A Q03164 1/20 0.35
▸ RAB9A P51151 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ DRD3 P35462 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
SCHEMBL9324412 0.85 TRPM8 (0.35) SIGMAR1MAOBTAAR1TRPM8CYP1A2
SCHEMBL9325748 0.83 KCNH2 (0.49) TRPM8KMT2AMAPTALDH1A1
SCHEMBL9324433 0.80 SIGMAR1 (0.39) SIGMAR1MAOBTAAR1CYP2D6MAPT
SCHEMBL10529828 0.72 HTR2A (0.45) KMT2ARAB9AMAPTALDH1A1
SCHEMBL9325455 0.71 HTR2A (0.39) SIGMAR1MAOBTAAR1KMT2ARAB9A
SCHEMBL9324295 0.70 KCNH2 (0.49) TRPM8KMT2AMAPTALDH1A1
SCHEMBL9279890 0.69 TAAR1 (0.46) TAAR1TRPM8KMT2ATSHRALDH1A1
SCHEMBL28406689 0.68 SIGMAR1 (0.77) SIGMAR1DRD3
SCHEMBL9326153 0.68 DRD2 (0.37) SIGMAR1MAOBTAAR1MAPTDRD2
SCHEMBL28388782 0.67 RAB9A (0.41) TAAR1TRPM8KMT2ARAB9AL3MBTL1

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-5310941-A Antiarrythmia agents ORTHO PHARMACEUTICAL CORPORATION (US) 1994-05-10 — — US disclosed
US-5208252-A Antiarrhythmia ORTHO PHARMACEUTICAL CORPORATION (US) 1993-05-04 — — US disclosed
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