SCHEMBL8917934

SCHEMBL8917934

Cc1ccc2c(N3CC[N]CC3)coc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALOX15 P16050 1/20 0.39
PHGDH O43175 1/20 0.39
NPC1 O15118 2/20 0.39
TP53 P04637 2/20 0.39
TSHR P16473 2/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HTT P42858 2/20 0.37
MAOB P27338 1/20 0.36
PRKDC P78527 1/20 0.36
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
ADRB2 P07550 2/20 0.34
ALDH1A1 P00352 2/20 0.33
ADRA2A P08913 1/20 0.33
HTR2C P28335 1/20 0.33
AXL P30530 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
SCHEMBL8917729 0.88 PRKDC (0.45) MAPTPHGDHTP53TSHRPOLB
SCHEMBL8916922 0.82 CYP11B1 (0.37) SMN1; SMN2PHGDHNPC1RAB9AHTT
SCHEMBL8916927 0.73 PTPN1 (0.40) MAPTPHGDHTP53HTTLMNA
SCHEMBL5771054 0.72 MAPT (0.47) MAPTSMN1; SMN2NPC1TP53TSHR
SCHEMBL2836561 0.72 MAPT (0.51) MAPTSMN1; SMN2TP53TSHRPOLB
SCHEMBL3123741 0.72 MAPT (0.54) MAPTSMN1; SMN2TP53TSHRPOLB
SCHEMBL8917168 0.70 PRKDC (0.44) MAPTPHGDHPOLBPRKDCALDH1A1
SCHEMBL8918038 0.70 ADORA2A (0.37) MAPTSMN1; SMN2ALOX15PHGDHTSHR
SCHEMBL8917044 0.70 MAPT (0.48) MAPTTP53POLBLMNAALDH1A1
SCHEMBL8917923 0.70 MAPT (0.39) MAPTSMN1; SMN2ALOX15TP53TSHR

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