SCHEMBL9203755

SCHEMBL9203755

O=C(c1ccc(F)cc1F)N1CCN(Cc2ccccc2)CC1

nearest known ligand 0.85

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.64
ALDH1A1 P00352 2/20 0.64
HTT P42858 2/20 0.64
TSHR P16473 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
EEF2K O00418 1/20 0.60

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
SCHEMBL9201688 0.85 PHGDH (0.55) KDM4EALDH1A1SMN1; SMN2EEF2K
SCHEMBL4602793 0.83 KDM4E (0.51) KDM4EALDH1A1HTT
SCHEMBL7130439 0.81 LMNA (0.72) KDM4EALDH1A1HTTTSHRSMN1; SMN2
SCHEMBL7474168 0.81 KDM4E (0.76) KDM4EALDH1A1TSHRSMN1; SMN2
SCHEMBL27911661 0.80 SIGMAR1 (0.58)
SCHEMBL4605773 0.79 LMNA (0.52) HTTSMN1; SMN2
SCHEMBL224090 0.78 MEN1 (0.70) KDM4EALDH1A1TSHRSMN1; SMN2
SCHEMBL4601925 0.78 KDM4E (0.54) KDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL642396 0.77 KDM4E (0.64) KDM4EHTTSMN1; SMN2
SCHEMBL30064781 0.76

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0353821-B1 Antipsychotic 3-piperazinyl-benzazole derivatives JANSSEN PHARMACEUTICA NV (BE) 1995-05-10 EP disclosed
US-5015740-A Psychological disorders JANSSEN PHARMACEUTICA N.V. (BE) 1991-05-14 US disclosed
US-4957916-A DISORDERS CONNECTED WITH DOPAMINE AND/OR SEROTONIN RELEASE JANSSEN PHARMACEUTICA N.V. (BE) 1990-09-18 US disclosed
EP-0353821-A2 Antipsychotic 3-piperazinyl-benzazole derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1990-02-07 EP disclosed