SCHEMBL10723719

SCHEMBL10723719

CC(NC(=O)c1ccc(Cl)cc1)N1CCN(C(C)NC(=O)c2ccc(Cl)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.54
P2RX7 Q99572 1/20 0.51
CCR1 P32246 6/20 0.49
CHRNA7 P36544 1/20 0.49
POLB P06746 2/20 0.48
ALDH1A1 P00352 3/20 0.47
MAPT P10636 3/20 0.47
TRPA1 O75762 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GPR139 Q6DWJ6 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
KCNH2 Q12809 1/20 0.45

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
SCHEMBL28644461 0.90 SMN1; SMN2 (0.58) HTTPOLBALDH1A1MAPTSMN1; SMN2
SCHEMBL9386877 0.90 OPRD1 (0.49) HTTP2RX7CCR1POLBALDH1A1
SCHEMBL10722405 0.83 ALDH1A1 (0.54) HTTCCR1POLBALDH1A1MAPT
SCHEMBL10756639 0.81 HTT (0.64) HTTP2RX7CCR1POLBALDH1A1
SCHEMBL8185351 0.78 HTT (0.65) HTTP2RX7POLBALDH1A1MAPT
SCHEMBL10617245 0.77 HTT (0.62) HTTP2RX7POLBALDH1A1MAPT
SCHEMBL3364780 0.76 CYP1A2 (0.50) HTTALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL10724188 0.74 HTT (0.51) HTTCCR1POLBALDH1A1KDM4E
SCHEMBL12377256 0.74 HTT (0.59) HTTP2RX7ALDH1A1MAPTTRPA1
SCHEMBL2172294 0.74 CA2 (0.61) HTTP2RX7POLBALDH1A1MAPT

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-4665410-A THERMOGRAPHY RICOH COMPANY, LTD. (JP) 1987-05-12 US disclosed
US-4613878-A DECOLORIZING AGENT COMPRISING AROMATIC DIAMIDE OR PIPERAZINE DERIVATIVE, HAVING TWO ACYLAMINO GROUPS RICOH COMPANY, LTD. (JP) 1986-09-23 US disclosed