SCHEMBL7316637

SCHEMBL7316637

[CH2]OCCCNCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.64
CHRM2 P08172 1/20 0.62
DRD4 P21917 3/20 0.59
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
SCN8A Q9UQD0 1/20 0.58
SIGMAR1 Q99720 3/20 0.58
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
DRD2 P14416 1/20 0.51
DRD3 P35462 1/20 0.51
KDM4E B2RXH2 1/20 0.51
PPARG P37231 1/20 0.50
BCHE P06276 1/20 0.49
MPO P05164 1/20 0.49

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
SCHEMBL893154 0.81 MAOA (0.86) MAOACHRM2DRD4MEN1KMT2A
SCHEMBL4932707 0.81 MAOA (0.95) MAOACHRM2MEN1KMT2ATDP1
SCHEMBL7316643 0.81 MAOA (0.64) MAOACHRM2DRD4MEN1KMT2A
SCHEMBL15341674 0.79 MAOA (0.62) MAOACHRM2DRD4MEN1KMT2A
Hydrochloric Acid SCHEMBL11130174 0.79 DRD4 (0.79) MAOACHRM2DRD4KMT2ASCN8A
SCHEMBL8851048 0.79 MAOA (1.00) MAOACHRM2MEN1KMT2ATDP1
SCHEMBL16260102 0.79 MAOA (1.00) MAOACHRM2MEN1KMT2ATDP1
SCHEMBL4642587 0.79 MAOA (1.00) MAOACHRM2MEN1KMT2ATDP1
SCHEMBL7202099 0.79 MAOA (1.00) MAOACHRM2MEN1KMT2ATDP1
Hydrochloric Acid SCHEMBL3524869 0.79 MAOA (0.82) MAOACHRM2DRD4MEN1KMT2A

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-4918074-A CALCIUM ANTAGONISTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1990-04-17 US disclosed
EP-0217142-A2 A polyazaheterocyclic compound Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1987-04-08 EP disclosed