SCHEMBL6985229

SCHEMBL6985229

O=C(c1ccc(F)cc1Cl)N1CCC(F)(CN2C(=O)c3ccccc3C2=O)CC1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.55
P2RX7 Q99572 12/20 0.47
HSD11B1 P28845 1/20 0.46
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.44
UBE2M P61081 1/20 0.43
DCUN1D1 Q96GG9 1/20 0.43
MAPK8 P45983 1/20 0.41
MAPK10 P53779 1/20 0.41

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
SCHEMBL6984019 0.81 HTR1A (0.59)
SCHEMBL6983350 0.81 HTR1A (0.55) POLB
SCHEMBL5654896 0.78 ALDH1A1 (0.57) POLB
SCHEMBL31197153 0.72 NPC1 (0.74) NPC1P2RX7HSD11B1MAPTUBE2M
SCHEMBL27972639 0.72 CA12 (0.43)
SCHEMBL14525211 0.72 PLA2G7 (0.45)
SCHEMBL3768547 0.70 P2RX7 (0.57) NPC1P2RX7HSD11B1
SCHEMBL2881785 0.70 USP1 (0.56) KDM4E
SCHEMBL25336731 0.69 LMNA (0.45)
SCHEMBL30554691 0.69 LMNA (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946546-B1 PYRIDIN-2-YL-METHYLAMINE DERIVATIVES, METHOD OF PREPARING AND APPLICATION AS MEDICINE PF MEDICAMENT (FR) 2003-06-25 EP disclosed
US-6020345-A Pyridin-2-yl-methylamine derivatives, method of preparing and application as medicine PIERRE FABRE MEDICAMENT (FR) 2000-02-01 US disclosed
EP-0946546-A1 PYRIDIN-2-YL-METHYLAMINE DERIVATIVES, METHOD OF PREPARING AND APPLICATION AS MEDICINE PIERRE FABRE MEDICAMENT (FR) 1999-10-06 EP disclosed
WO-1998022459-A1 PYRIDIN-2-YL-METHYLAMINE DERIVATIVES, METHOD OF PREPARING AND APPLICATION AS MEDICINE PIERRE FABRE MEDICAMENT (FR) 1998-05-28 WO disclosed