SCHEMBL7984137

SCHEMBL7984137

NC1(c2ccccc2F)CCCc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 7/20 0.50
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
AKR1B1 P15121 1/20 0.40
MAOB P27338 1/20 0.39
HDAC4 P56524 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
SCHEMBL11696762 0.80 KDM1A (0.54) KDM1AMEN1KMT2AAKR1B1
SCHEMBL1101137 0.74 KDM1A (0.59) KDM1AMEN1KMT2AAKR1B1MAOB
SCHEMBL30112838 0.74 KDM1A (0.59) KDM1AMEN1KMT2AAKR1B1MAOB
SCHEMBL4784319 0.72 KDM1A (0.46) KDM1AMEN1KMT2A
Hydrochloric Acid SCHEMBL7755304 0.71 KDM1A (0.45) KDM1AMEN1KMT2A
SCHEMBL5369769 0.71 KDM1A (0.56) KDM1AMEN1KMT2AAKR1B1MAOB
SCHEMBL643388 0.71 KDM1A (0.66) KDM1AMEN1KMT2AAKR1B1MAOB
SCHEMBL1273553 0.71 KDM1A (0.66) KDM1AMEN1KMT2AAKR1B1MAOB
SCHEMBL4144872 0.71 KDM1A (0.56) KDM1AMEN1KMT2AAKR1B1MAOB
SCHEMBL9396129 0.71 KDM1A (0.56) KDM1AMEN1KMT2AAKR1B1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001089453-A2 DERIVATIVES OF 2-AMINOTETRALINS AND PHARMACEUTICAL ANALOGS THEREOF EXHIBITING DIFFERENTIAL CNS RECEPTOR ACTIVITY AND BEHAVIOR WAYNE STATE UNIVERSITY (US) 2001-11-29 WO disclosed