SCHEMBL10168008

SCHEMBL10168008

CNCC(=O)NCCN1CCC(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 13/20 0.61
KIF11 P52732 1/20 0.58
RAD52 P43351 3/20 0.57
LMNA P02545 6/20 0.57
MAPT P10636 6/20 0.57
SMN1; SMN2 Q16637 5/20 0.57
CYP3A4 P08684 4/20 0.57
MAPK1 P28482 4/20 0.57
TP53 P04637 3/20 0.57
ALDH1A1 P00352 2/20 0.57
CYP1A2 P05177 2/20 0.57
ABCB1 P08183 2/20 0.57
HTR1A P08908 2/20 0.57
ADRA2A P08913 2/20 0.57
ADORA3 P0DMS8 2/20 0.57
CYP2D6 P10635 2/20 0.57
CHRM1 P11229 2/20 0.57
DRD2 P14416 2/20 0.57
ADRA2B P18089 2/20 0.57
ADRA2C P18825 2/20 0.57

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
SCHEMBL4271320 0.97 FPR2 (0.62) FPR2KIF11RAD52LMNAMAPT
SCHEMBL10168006 0.91 FPR2 (0.62) FPR2KIF11RAD52LMNAMAPT
SCHEMBL10168005 0.91 FPR2 (0.64) FPR2KIF11RAD52LMNAMAPT
SCHEMBL10168902 0.91 KIF11 (0.70) FPR2KIF11RAD52LMNAMAPT
SCHEMBL10168440 0.88 FPR2 (0.68) FPR2KIF11RAD52LMNAMAPT
SCHEMBL4281060 0.87 FPR2 (0.68) FPR2KIF11RAD52LMNAMAPT
SCHEMBL4284895 0.87 FPR2 (0.64) FPR2KIF11RAD52LMNAMAPT
SCHEMBL13693101 0.85 HRH1 (0.53) FPR2RAD52LMNAMAPTSMN1; SMN2
SCHEMBL10168895 0.84 KIF11 (0.68) FPR2KIF11RAD52LMNAMAPT
SCHEMBL13346862 0.83 LMNA (0.79) FPR2RAD52LMNAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120035161-A1 Novel Compositions and Methods of Treating Diseases Using the Same CORRIDOR PHARMACEUTICALS, INC. 2012-02-09 US disclosed
US-7981885-B2 N-[3-substituted piperazino] alkylphenothiazines; antiproliferative agents, apoptotic agents; 5-HT receptor antagonists IMMUNE CONTROL INC. (US) 2011-07-19 US disclosed
US-7981885-B2 N-[3-substituted piperazino] alkylphenothiazines; antiproliferative agents, apoptotic agents; 5-HT receptor antagonists IMMUNE CONTROL INC. (US) 2011-07-19 US disclosed
US-7923445-B2 10-{3-[4-(2-Amino)ethylpiperazinyl]propyl}2-trifluoromethylphenothiazine and analogues and derivatives; antiproliferative agents; serotonin receptor antagonists; apoptosis in activated lymphocytes, including T, B, and and mylenoma cells; asthma; antiarthritic agents; rheumatic diseeases IMMUNE CONTROL, INC. (US) 2011-04-12 US disclosed
US-7923445-B2 10-{3-[4-(2-Amino)ethylpiperazinyl]propyl}2-trifluoromethylphenothiazine and analogues and derivatives; antiproliferative agents; serotonin receptor antagonists; apoptosis in activated lymphocytes, including T, B, and and mylenoma cells; asthma; antiarthritic agents; rheumatic diseeases IMMUNE CONTROL, INC. (US) 2011-04-12 US disclosed
US-20100130457-A1 Phenothiazine Derivatives for Treatment of Asthma IMMUNE CONTROL, INC. 2010-05-27 US disclosed
US-20100130457-A1 Phenothiazine Derivatives for Treatment of Asthma IMMUNE CONTROL, INC. 2010-05-27 US disclosed
US-20100035858-A1 Novel Compositions and Methods for Binding and Inhibiting 5-HT4 Receptor IMMUNE CONTROL, INC. 2010-02-11 US disclosed
US-20100035858-A1 Novel Compositions and Methods for Binding and Inhibiting 5-HT4 Receptor IMMUNE CONTROL, INC. 2010-02-11 US disclosed
WO-2010009332-A1 BINDING AND INHIBITING 5-HT4 RECEPTOR IMMUNE CONTROL, INC. (US) 2010-01-21 WO disclosed
US-20080132697-A1 Novel compositions for treatment of diseases related to activated lymphocytes IMMUNE CONTROL, INC. (US) 2008-06-05 US disclosed
US-20080132697-A1 Novel compositions for treatment of diseases related to activated lymphocytes IMMUNE CONTROL, INC. (US) 2008-06-05 US disclosed
US-20080125415-A1 Novel methods for treatment of diseases related to activated lymphocytes IMMUNE CONTROL, INC. (US) 2008-05-29 US disclosed
US-20080125415-A1 Novel methods for treatment of diseases related to activated lymphocytes IMMUNE CONTROL, INC. (US) 2008-05-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100130457-A1 Phenothiazine Derivatives for Treatment of Asthma IL5, HRH4, TLR5 FPR2 80/4885KIF11 3497/4885RAD52 3707/4885
US-20100035858-A1 Novel Compositions and Methods for Binding and Inhibiting 5-HT4 Receptor HTR4, HTR3B, HTR5A FPR2 70/4885KIF11 3921/4885RAD52 3034/4885
US-20080132697-A1 Novel compositions for treatment of diseases related to activated lymphocytes NFATC1, CD4, TPH1 FPR2 43/4885KIF11 4417/4885RAD52 3326/4885
US-20120035161-A1 Novel Compositions and Methods of Treating Diseases Using the Same NFATC1, BAX, BCL2 FPR2 153/4885KIF11 3636/4885RAD52 3198/4885
US-20080125415-A1 Novel methods for treatment of diseases related to activated lymphocytes HTR5A, TPH1, TPH2 FPR2 47/4885KIF11 4402/4885RAD52 2652/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.