SCHEMBL7387362

SCHEMBL7387362

CN(CCCCN1CCC(CN)C1)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.47
ACHE P22303 5/20 0.46
SIGMAR1 Q99720 3/20 0.46
CARM1 Q86X55 2/20 0.46
PRMT6 Q96LA8 2/20 0.46
PRMT8 Q9NR22 1/20 0.46
KCNH2 Q12809 1/20 0.45
CCR3 P51677 1/20 0.44

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
SCHEMBL7386201 0.91 KCNH2 (0.52) MAOBACHESIGMAR1CARM1PRMT6
SCHEMBL7392437 0.76 MAOB (0.56) MAOBACHESIGMAR1
SCHEMBL5779205 0.76 CCR3 (0.64) ACHESIGMAR1CARM1PRMT6PRMT8
SCHEMBL4018369 0.75 CHRM3 (0.52) MAOBACHESIGMAR1KCNH2
SCHEMBL7391864 0.75 SIGMAR1 (0.58) MAOBACHESIGMAR1
SCHEMBL30380307 0.75 SIGMAR1 (0.60) MAOBSIGMAR1CARM1PRMT6PRMT8
SCHEMBL8651374 0.73 HTR1D (0.49) SIGMAR1CARM1PRMT6KCNH2
SCHEMBL3074896 0.72 CCR3 (0.62) ACHESIGMAR1CARM1PRMT6PRMT8
SCHEMBL242758 0.72 CCR3 (0.62) ACHESIGMAR1CARM1PRMT6PRMT8
SCHEMBL1180490 0.72 CCR3 (0.62) ACHESIGMAR1CARM1PRMT6PRMT8

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-5864039-A THERAPEUTIC TREATMENT OF VARIOUS GASTROINTESTINAL DISEASES, CENTRAL NERVOUS DISORDERS, CARDIOVASCULAR DISORDERS, URINARY DISEASES, UROGENITAL DISORDERS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1999-01-26 US disclosed
EP-0873990-A1 BENZOIC ACID COMPOUNDS AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1998-10-28 EP disclosed