SCHEMBL7364388

SCHEMBL7364388

N#Cc1cccc(CC(N)c2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.56
SLC6A4 P31645 1/20 0.56
FOLH1 Q04609 1/20 0.47
GLA P06280 1/20 0.44
CNR1 P21554 2/20 0.43
DPP4 P27487 2/20 0.43
DPP7 Q9UHL4 2/20 0.43
TACR1 P25103 1/20 0.43
MRGPRX1 Q96LB2 1/20 0.43
FAP Q12884 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP9 Q86TI2 1/20 0.43
PIN1 Q13526 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KDM1A O60341 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
EPHX1 P07099 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
SCHEMBL7359657 0.90 SLC6A2 (0.46) SLC6A2SLC6A4FOLH1GLADPP4
SCHEMBL6331351 0.90 SLC6A2 (0.49) SLC6A2SLC6A4CNR1TACR1MRGPRX1
SCHEMBL17266185 0.90 SLC6A2 (0.49) SLC6A2SLC6A4CNR1TACR1MRGPRX1
SCHEMBL4749835 0.86 FOLH1 (0.44) SLC6A2SLC6A4FOLH1GLADPP4
SCHEMBL17253753 0.81 MAOB (0.47) SLC6A2SLC6A4MAOAMAOBTSHR
SCHEMBL18539225 0.81 KDM1A (0.46) SLC6A2SLC6A4GLADPP7TACR1
Hydrochloric Acid SCHEMBL3519614 0.81 SLC6A2 (0.50) SLC6A2SLC6A4FOLH1GLACNR1
SCHEMBL17463687 0.81 SLC6A2 (0.44) SLC6A2SLC6A4CNR1TACR1MRGPRX1
SCHEMBL7359666 0.81 LOXL2 (0.47) CNR1GRM4
SCHEMBL7363755 0.81 KCNJ1 (0.54) SLC6A2SLC6A4FOLH1GLADPP4

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-0892780-A1 M-AMIDINO PHENYL ANALOGS AS FACTOR Xa INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1999-01-27 EP disclosed
WO-1997030971-A1 M-AMIDINO PHENYL ANALOGS AS FACTOR Xa INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1997-08-28 WO disclosed