SCHEMBL7390423

SCHEMBL7390423

Nc1cccc(C(=O)CCCCCN2CC[CH]CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 6/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ DRD2 P14416 5/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ HTR7 P34969 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ADRA1D P25100 1/20 0.40
▸ ADRA1A P35348 1/20 0.40
▸ ADRA1B P35368 1/20 0.40

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
SCHEMBL7391718 0.86 DRD4 (0.47) DRD4L3MBTL1KDM4EDRD2HTR7
SCHEMBL7390484 0.85 DRD4 (0.54) DRD4L3MBTL1KDM4EDRD2HTR1A
SCHEMBL7394247 0.85 DRD4 (0.49) DRD4L3MBTL1KDM4EDRD2DRD3
SCHEMBL7390338 0.85 DRD2 (0.56) DRD4L3MBTL1KDM4EDRD2HTR1A
SCHEMBL7389570 0.85 DRD4 (0.54) DRD4L3MBTL1KDM4EDRD2HTR1A
SCHEMBL7390664 0.84 HTR1A (0.53) DRD4L3MBTL1KDM4EDRD2HTR1A
SCHEMBL7390493 0.84 MAPT (0.61) L3MBTL1DRD2HTR1AHTR2AHTR7
SCHEMBL7390501 0.84 MAPT (0.61) L3MBTL1DRD2HTR1AHTR2AHTR7
SCHEMBL7386508 0.84 MAPT (0.61) L3MBTL1DRD2HTR1AHTR2AHTR7
SCHEMBL7387492 0.82 DRD4 (0.47) DRD4L3MBTL1KDM4EDRD2

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
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