SCHEMBL7968924

SCHEMBL7968924

NC(=O)C1CCN(C2CCC(c3ccccc3F)CC2)C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.43
DPP9 Q86TI2 3/20 0.43
DPP7 Q9UHL4 3/20 0.43
DPP8 Q6V1X1 2/20 0.43
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
PARP10 Q53GL7 1/20 0.40
NOTUM Q6P988 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
OPRL1 P41146 2/20 0.39
ABCB1 P08183 1/20 0.39
MGLL Q99685 1/20 0.39
NAMPT P43490 1/20 0.39
PROKR1 Q8TCW9 1/20 0.39
DRD4 P21917 1/20 0.38

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
SCHEMBL7955781 1.00 DPP4 (0.43) DPP4DPP9DPP7DPP8KDM4E
SCHEMBL7968925 0.81 KDM1A (0.46) DPP4DPP9DPP7DPP8KDM4E
SCHEMBL7955785 0.81 KDM1A (0.46) DPP4DPP9DPP7DPP8KDM4E
Hydrochloric Acid SCHEMBL7965168 0.80 KDM1A (0.45) DPP4DPP9DPP7DPP8KDM4E
Hydrochloric Acid SCHEMBL7965167 0.80 KDM1A (0.45) DPP4DPP9DPP7DPP8KDM4E
SCHEMBL7970182 0.78 DPP4 (0.49) DPP4DPP9DPP7DPP8KDM4E
SCHEMBL15422012 0.76 CHRM1 (0.49) DPP4DPP9DPP7DPP8MEN1
SCHEMBL10736440 0.76 KDM1A (0.41) DPP4DPP9DPP7DPP8KDM4E
SCHEMBL10738870 0.76 KDM1A (0.41) DPP4DPP9DPP7DPP8KDM4E
Hydrochloric Acid SCHEMBL2146257 0.74 CHRM1 (0.47) DPP4DPP9DPP7DPP8MEN1

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-6255315-B1 BENIGN PROSTATIC HYPERPLASIA MERCK & CO., INC. 2001-07-03 US disclosed
US-6037354-A ADMINISTERING PHENYL-SUBSTITUTED THIAZOLIDIN-4-ONE OR OXAZOLIDIN-2-ONE DERIVATIVE TO TREAT BENIGN PROSTATE HYPERPLASIA; SIDE EFFECT REDUCTION MERCK & CO., INC. (US) 2000-03-14 US disclosed