SCHEMBL30102484

SCHEMBL30102484

CCc1cc(NCCOCc2ccccc2)c(N)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
P4HB P07237 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
PTGER4 P35408 2/20 0.36
DRD4 P21917 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 2/20 0.33
TSHR P16473 1/20 0.33
NCF1 P14598 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL30102408 0.88 KCNQ2 (0.36) KDM4ESMN1; SMN2PTGER4LMNARAB9A
SCHEMBL30102414 0.79 PTGER4 (0.33) PTGER4ALDH1A1MAPT
SCHEMBL30102413 0.79 HAT1 (0.36) SMN1; SMN2PTGER4LMNAALDH1A1MAPT
SCHEMBL30102431 0.74 DRD2 (0.44) KDM4ESMN1; SMN2PTGER4DRD4LMNA
SCHEMBL30102415 0.74 ACHE (0.33) PTGER4
SCHEMBL30102382 0.72 HDAC8 (0.46) KDM4EHDAC6RAB9ANPC1
SCHEMBL10368992 0.72 GAA (0.50) KDM4ESMN1; SMN2HTTLMNARAB9A
SCHEMBL413427 0.71 TDP1 (0.56) KDM4ESMN1; SMN2LMNAALDH1A1MAPT
SCHEMBL18289061 0.70 ALDH1A1 (0.43) SMN1; SMN2HTTLMNARAB9ATSHR
SCHEMBL27883917 0.68 MEN1 (0.44) KDM4ESMN1; SMN2HTTLMNATSHR

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-2022272313-A1 MODULATORS OF HISTONE ACETYLTRANSFERASE 1 AND METHODS OF TREATMENT THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2022-12-29 WO disclosed