SCHEMBL6008656

SCHEMBL6008656

O=CNC(Cc1ccc(Cl)c(Cl)c1)CN1CCC(Cc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
ATM Q13315 3/20 0.47
CCR3 P51677 3/20 0.47
GRIN2D O15399 3/20 0.46
GRIN3B O60391 3/20 0.46
ADRA1D P25100 3/20 0.46
ADRA1A P35348 3/20 0.46
ADRA1B P35368 3/20 0.46
GRIN1 Q05586 3/20 0.46
GRIN2A Q12879 3/20 0.46
GRIN2B Q13224 3/20 0.46
GRIN2C Q14957 3/20 0.46
GRIN3A Q8TCU5 3/20 0.46
NPFFR1 Q9GZQ6 1/20 0.46
NPFFR2 Q9Y5X5 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL6007980 0.86 CARM1 (0.52) ALDH1A1ATMCCR3GRIN2DGRIN3B
SCHEMBL6007453 0.85 ALDH1A1 (0.49) ALDH1A1ATMCCR3GRIN2DGRIN3B
SCHEMBL6009314 0.84 SLC6A2 (0.50) ALDH1A1ATMCCR3GRIN2DGRIN3B
SCHEMBL6008676 0.83 CCR3 (0.61) CCR3GRIN2DGRIN3BADRA1DADRA1A
SCHEMBL6008834 0.83 SIGMAR1 (0.56) ALDH1A1ATMCCR3GRIN2DGRIN3B
SCHEMBL6009351 0.81 GRIN2D (0.50) ALDH1A1CCR3GRIN2DGRIN3BADRA1D
SCHEMBL5759901 0.81 POLB (0.51) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
Hydrochloric Acid SCHEMBL6007920 0.80 GRIN2D (0.49) ALDH1A1GRIN2DGRIN3BADRA1DADRA1A
SCHEMBL6009428 0.80 ALDH1A1 (0.53) ALDH1A1ATMCCR3GRIN2DGRIN3B
Hydrochloric Acid SCHEMBL6007421 0.79 ALDH1A1 (0.52) ALDH1A1ATMCCR3GRIN2DGRIN3B

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-7078537-B2 Phenylalkyl diamine and amide analogs SK CORPORATION (KR) 2006-07-18 US claimed
US-7078537-B2 Phenylalkyl diamine and amide analogs SK CORPORATION (KR) 2006-07-18 US disclosed