SCHEMBL8917923

SCHEMBL8917923

Cc1ccc2c(C3CC[N]CC3)coc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.39
ALOX15 P16050 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 4/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
DRD2 P14416 2/20 0.38
SLC6A4 P31645 1/20 0.38
TSHR P16473 2/20 0.36
PSMB8 P28062 3/20 0.34
STS P08842 1/20 0.34
KDM4E B2RXH2 3/20 0.33
HPGD P15428 2/20 0.33
HTR2A P28223 1/20 0.33
DRD3 P35462 1/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.32
GFER P55789 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL8920622 0.88 ALDH1A1 (0.39) MAPTSMN1; SMN2ALDH1A1DRD2SLC6A4
SCHEMBL8917899 0.82 CYP11B1 (0.40) DRD2SLC6A4STSHTR2ADRD3
SCHEMBL20809217 0.82 HTR2C (0.46) MAPTALOX15SMN1; SMN2ALDH1A1TP53
SCHEMBL8917953 0.81 PSMB8 (0.40) ALOX15ALDH1A1DRD2SLC6A4PSMB8
Hydrochloric Acid SCHEMBL20135194 0.81 HTR2C (0.47) MAPTALOX15SMN1; SMN2ALDH1A1TP53
SCHEMBL7700928 0.78 DRD2 (0.55) SMN1; SMN2ALDH1A1DRD2SLC6A4HTR2A
SCHEMBL8920208 0.77 PTPN1 (0.43) ALDH1A1DRD2SLC6A4TSHRPSMB8
SCHEMBL8916199 0.76 KMT2A (0.39) MAPTSMN1; SMN2ALDH1A1POLBTSHR
SCHEMBL8916173 0.73 PTPN1 (0.40) MAPTSMN1; SMN2ALDH1A1DRD2SLC6A4
SCHEMBL8918420 0.73 PTPN1 (0.40) DRD2SLC6A4KDM4EHTR2ADRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US claimed
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed