SCHEMBL9853919

SCHEMBL9853919

O=C(Cl)c1ccccc1C(=O)N1CCN(CCCc2ccccc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.64
KDM4E B2RXH2 3/20 0.60
ALDH1A1 P00352 3/20 0.60
LMNA P02545 1/20 0.60
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
FAAH O00519 1/20 0.57
POLB P06746 1/20 0.57
GAA P10253 1/20 0.57
KCNH2 Q12809 1/20 0.57
ALOX15 P16050 1/20 0.56
CCR3 P51677 1/20 0.51

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
SCHEMBL15961276 0.82 SIGMAR1 (0.91) SIGMAR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL27564901 0.80 SIGMAR1 (0.73) SIGMAR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL7130439 0.78 LMNA (0.72) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL25237094 0.78 SIGMAR1 (1.00) SIGMAR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL7287285 0.78 SIGMAR1 (0.74) SIGMAR1FAAH
Hydrochloric Acid SCHEMBL11788606 0.78 ALDH1A1 (0.74) SIGMAR1KDM4EALDH1A1LMNAMEN1
SCHEMBL11788348 0.77 ALDH1A1 (0.68) SIGMAR1KDM4EALDH1A1LMNAFAAH
SCHEMBL30671731 0.77 SIGMAR1 (0.97) SIGMAR1KDM4EALDH1A1MEN1KMT2A
SCHEMBL17695832 0.76 SIGMAR1 (0.76) SIGMAR1KDM4EALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL11788201 0.76 ALDH1A1 (0.67) SIGMAR1KDM4EALDH1A1LMNAFAAH

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
EP-0425134-A1 Condensed pyrrolo derivatives, process for their preparation and pharmaceutical compositions containing them YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1991-05-02 EP disclosed