SCHEMBL9082173

SCHEMBL9082173

[CH2]N(C)CCc1ccccn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.55
TDP1 Q9NUW8 3/20 0.55
TSHR P16473 2/20 0.55
NPSR1 Q6W5P4 1/20 0.55
POLB P06746 1/20 0.55
HRH1 P35367 1/20 0.52
HRH3 Q9Y5N1 1/20 0.52
CYP1A2 P05177 2/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2D6 P10635 2/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 2/20 0.51
RECQL P46063 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
MAPT P10636 2/20 0.50
ALDH1A1 P00352 2/20 0.50
ATM Q13315 1/20 0.50
LIN28A Q9H9Z2 1/20 0.50
LMNA P02545 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50

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
SCHEMBL229256 0.84 KDM4E (0.58) KDM4ETDP1TSHRNPSR1POLB
SCHEMBL31059180 0.84 KDM4E (0.68) KDM4ETDP1TSHRNPSR1POLB
SCHEMBL12819456 0.84 KDM4E (0.68) KDM4ETDP1TSHRNPSR1POLB
SCHEMBL31059181 0.84 KDM4E (0.68) KDM4ETDP1TSHRNPSR1POLB
SCHEMBL30086100 0.84 KDM4E (0.58) KDM4ETDP1TSHRNPSR1POLB
Hydrochloric Acid SCHEMBL29367467 0.82 KDM4E (0.57) KDM4ETDP1TSHRNPSR1POLB
SCHEMBL14048279 0.81 KDM4E (0.55) KDM4ETDP1TSHRNPSR1POLB
SCHEMBL6785130 0.80 KDM4E (0.59) KDM4ETDP1TSHRNPSR1POLB
SCHEMBL14191759 0.80 KDM4E (0.51) KDM4ETDP1TSHRNPSR1POLB
SCHEMBL3459116 0.80 TDP1 (0.59) KDM4ETDP1TSHRNPSR1POLB

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-1996034866-A1 IMIDAZO 1,2-A PYRIDINE AND IMIDAZO 1,2-A PYRIDEZINE DERIVATIVES AND THEIR USE AS BONE RESORPTION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-07 WO disclosed