SCHEMBL9212508

SCHEMBL9212508

COCc1ccc(CNCCN)o1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 4/20 0.45
▸ HRH3 Q9Y5N1 1/20 0.34
▸ MC4R P32245 1/20 0.33
▸ MC5R P33032 1/20 0.33
▸ ACHE P22303 2/20 0.33
▸ AMY1A P0DUB6 1/20 0.33
▸ USP2 O75604 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HTR6 P50406 4/20 0.31
▸ HTR1A P08908 3/20 0.31
▸ DRD2 P14416 3/20 0.31
▸ HTR2A P28223 3/20 0.31
▸ HTR7 P34969 3/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ PRMT3 O60678 1/20 0.31
▸ CARM1 Q86X55 1/20 0.31
▸ PRMT6 Q96LA8 1/20 0.31

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
SCHEMBL18575565 0.85 CHRM2 (0.52) CHRM2MC4RMC5RACHEAMY1A
SCHEMBL19226117 0.78 CHRM2 (0.37) CHRM2HRH3MC4RMC5RACHE
SCHEMBL55096 0.77 DAO (0.38) ACHEHTTALDH1A1LMNA
SCHEMBL26230987 0.77 CHRM2 (0.44) CHRM2MC4RMC5RAMY1AALDH1A1
SCHEMBL10864363 0.77 CHRM2 (0.73) CHRM2MC4RMC5RAMY1AHTT
SCHEMBL9216895 0.76 PRMT6 (0.53) CHRM2ACHEPRMT6
SCHEMBL10864344 0.74 CHRM2 (0.42) CHRM2MC4RMC5RAMY1AALDH1A1
SCHEMBL10863545 0.74 CHRM2 (0.46) CHRM2MC4RMC5RAMY1AUSP2
SCHEMBL9211900 0.73 PRMT6 (0.50) CHRM2ACHEPRMT6
SCHEMBL10862582 0.73 CHRM2 (0.44) CHRM2MC4RMC5RAMY1AUSP2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0413343-B1 Furan derivatives KYOWA HAKKO KOGYO KK (JP) 1995-08-02 — — EP disclosed
US-5075301-A FURAN DERIVATIVES USEFUL FOR THE TREATMENT OF GASTRO-INTESTINAL DISORDERS KYOWA HAKKO KOGYO, CO., LTD. (JP) 1991-12-24 — — US disclosed
EP-0413343-A2 Furan derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-02-20 — — EP disclosed
Send feedback