SCHEMBL1070098

SCHEMBL1070098

CC(C)(C)OC(=O)NCCCC(=O)OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 12/20 0.62
RAD52 P43351 3/20 0.61
DRD2 P14416 3/20 0.60
DRD1 P21728 3/20 0.60
HRH1 P35367 3/20 0.60
DRD3 P35462 3/20 0.60
HRH3 Q9Y5N1 2/20 0.60
DRD5 P21918 2/20 0.60
LMNA P02545 6/20 0.59
MAPT P10636 6/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
CYP3A4 P08684 4/20 0.59
MAPK1 P28482 4/20 0.59
TP53 P04637 3/20 0.59
ALDH1A1 P00352 2/20 0.59
CYP1A2 P05177 2/20 0.59
ABCB1 P08183 2/20 0.59
HTR1A P08908 2/20 0.59
ADRA2A P08913 2/20 0.59
ADORA3 P0DMS8 2/20 0.59

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
SCHEMBL560221 0.90 KIF11 (0.68) FPR2RAD52DRD2DRD1HRH1
SCHEMBL8256027 0.89 DRD2 (0.56) FPR2RAD52DRD2DRD1HRH1
SCHEMBL560237 0.88 FPR2 (0.67) FPR2RAD52DRD2DRD1HRH1
SCHEMBL1070185 0.87 FPR2 (0.71) FPR2RAD52DRD2DRD1HRH1
SCHEMBL31322328 0.87 RAD52 (0.72) FPR2RAD52DRD2DRD1HRH1
SCHEMBL5801554 0.86 FPR2 (0.70) FPR2RAD52DRD2DRD1HRH1
SCHEMBL1067508 0.86 FPR2 (0.72) FPR2RAD52DRD2DRD1HRH1
SCHEMBL5803456 0.85 FPR2 (0.69) FPR2RAD52DRD2DRD1HRH1
SCHEMBL5802453 0.85 FPR2 (0.69) FPR2RAD52DRD2DRD1HRH1
SCHEMBL5802291 0.85 FPR2 (0.69) FPR2RAD52DRD2DRD1HRH1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2275143-B1 Conjugates of perphenazine or fluphenazine with carboxylic acids UNIV RAMOT (IL) 2012-12-19 EP disclosed
US-20120309748-A1 CONJUGATED PSYCHOTROPIC DRUGS AND USES THEREOF BAR-ILAN UNIVERSITY (IL) 2012-12-06 US disclosed
US-8283381-B2 Conjugated psychotropic drugs and uses thereof RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2012-10-09 US disclosed
US-8168628-B2 Conjugated psychotropic drugs and uses thereof RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2012-05-01 US disclosed
EP-1429844-B1 CONJUGATE OF PERPHENAZINE AND GABA AND USES THEREOF UNIV RAMOT (IL) 2012-01-18 EP disclosed
US-7939525-B2 Conjugated psychotropic drugs and uses thereof BAR-ILAN UNIVERSITY (IL) 2011-05-10 US disclosed
EP-2275143-A2 Conjugated anti-psychotic drugs and uses thereof Ramot at Tel Aviv University Ltd. (IL) 2011-01-19 EP disclosed
US-20100204469-A1 CONJUGATED PSYCHOTROPIC DRUGS AND USES THEREOF RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2010-08-12 US disclosed
US-20100120755-A1 Conjugated psychotropic drugs and uses thereof RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2010-05-13 US disclosed
US-20100063034-A1 Conjugated psychotropic drugs and uses thereof RAMOT AT TEL AVIV UNIVERSITY LTD. 2010-03-11 US disclosed
US-20080108606-A1 Conjugated psychotropic drugs and uses thereof RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2008-05-08 US disclosed
US-20070197514-A1 Conjugated psychotropic drugs and uses thereof RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2007-08-23 US disclosed
US-20070099977-A1 Conjugated psychotropic drugs and uses thereof RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2007-05-03 US disclosed
EP-1727566-A2 CONJUGATED PSYCHOTROPIC DRUGS AND USES THEREOF Ramot at Tel Aviv University Ltd. (IL) 2006-12-06 EP disclosed
EP-1429844-A4 CONJUGATED ANTI-PSYCHOTIC DRUGS AND USES THEREOF UNIV RAMOT (IL) 2006-06-07 EP disclosed
WO-2005092392-A2 CONJUGATED PSYCHOTROPIC DRUGS AND USES THEREOF RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2005-10-06 WO disclosed
US-20040242570-A1 Conjugated psychotropic drugs and uses thereof BAR-ILAN UNIVERSITY (IL) 2004-12-02 US disclosed
EP-1429844-A2 CONJUGATED ANTI-PSYCHOTIC DRUGS AND USES THEREOF Ramot at Tel Aviv University Ltd. (IL) 2004-06-23 EP disclosed
WO-2003026563-A9 CONJUGATED ANTI-PSYCHOTIC DRUGS AND USES THEREOF UNIV RAMOT (IL) 2004-04-22 WO disclosed
WO-2003026563-A2 CONJUGATED ANTI-PSYCHOTIC DRUGS AND USES THEREOF RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2003-04-03 WO 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 (8 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-20100063034-A1 Conjugated psychotropic drugs and uses thereof SLC18A2, SLC6A3, SLCO1B3 FPR2 2983/4885RAD52 4471/4885DRD2 32/4885
US-20040242570-A1 Conjugated psychotropic drugs and uses thereof SLC18A2, SLC6A3, SLCO1B3 FPR2 2983/4885RAD52 4471/4885DRD2 32/4885
US-20070099977-A1 Conjugated psychotropic drugs and uses thereof SLC18A2, SLC6A3, SLCO1B3 FPR2 2983/4885RAD52 4471/4885DRD2 32/4885
US-20100204469-A1 CONJUGATED PSYCHOTROPIC DRUGS AND USES THEREOF SLC18A2, SLC6A3, SLCO1B3 FPR2 2983/4885RAD52 4471/4885DRD2 32/4885
US-20100120755-A1 Conjugated psychotropic drugs and uses thereof SLC18A2, SLC6A3, SLCO1B3 FPR2 2983/4885RAD52 4471/4885DRD2 32/4885
US-20080108606-A1 Conjugated psychotropic drugs and uses thereof SLC18A2, SLC6A3, SLCO1B3 FPR2 2983/4885RAD52 4471/4885DRD2 32/4885
US-20070197514-A1 Conjugated psychotropic drugs and uses thereof SLC18A2, SLC6A3, SLCO1B3 FPR2 2983/4885RAD52 4471/4885DRD2 32/4885
US-20120309748-A1 CONJUGATED PSYCHOTROPIC DRUGS AND USES THEREOF SLC18A2, SLC6A3, SLCO1B3 FPR2 2983/4885RAD52 4471/4885DRD2 32/4885

“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.