SCHEMBL3967589

SCHEMBL3967589

FC(F)(F)c1ccc(-c2ccc(N3CCN(CC4CC4)CC3)nn2)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCD O00767 9/20 0.51
LMNA P02545 2/20 0.49
CNR2 P34972 1/20 0.46
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
THRB P10828 2/20 0.42
KDM2B Q8NHM5 1/20 0.40

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
SCHEMBL1742259 0.92 SCD (0.49) SCDLMNACNR2RAB9ANPC1
SCHEMBL1740036 0.87 LMNA (0.46) SCDLMNACNR2RAB9ANPC1
SCHEMBL3970574 0.84 MAPT (0.47) SCDCNR2RAB9ANPC1MEN1
SCHEMBL13648866 0.81 SCD (0.56) SCDLMNACNR2RAB9ANPC1
SCHEMBL1744270 0.81 NPC1 (0.42) SCDRAB9ANPC1MEN1KMT2A
SCHEMBL16013344 0.80 SCN9A (0.40) KDM2B
Hydrochloric Acid SCHEMBL3971198 0.80 SCD (0.55) SCDLMNACNR2RAB9ANPC1
SCHEMBL1742433 0.80 SCD (0.52) SCDRAB9ANPC1MEN1KMT2A
SCHEMBL13648802 0.79 SCD (0.54) SCDLMNACNR2RAB9ANPC1
SCHEMBL3970310 0.79 LMNA (0.45) LMNARAB9ANPC1MAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264435-A1 Novel Aryl- and Heteroarylpiperazines HIGH POINT PHARMACEUTICALS, LLC (US) 2009-10-22 US disclosed
US-20090264435-A1 Novel Aryl- and Heteroarylpiperazines HIGH POINT PHARMACEUTICALS, LLC (US) 2009-10-22 US disclosed
US-20090264435-A1 Novel Aryl- and Heteroarylpiperazines HIGH POINT PHARMACEUTICALS, LLC (US) 2009-10-22 US disclosed
EP-1474401-A2 NOVEL ARYL- AND HETEROARYLPIPERAZINES NOVO NORDISK A/S (DK) 2004-11-10 EP disclosed
US-20030236259-A1 Novel aryl- and heteroarylpiperazines HIGH POINT PHARMACEUTICALS, LLC 2003-12-25 US disclosed
WO-2003066604-A2 NOVEL ARYL- AND HETEROARYLPIPERAZINES NOVO NORDISK A/S (DK) 2003-08-14 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 (2 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-20030236259-A1 Novel aryl- and heteroarylpiperazines HRH3, HRH2, HRH4 SCD 3788/4885LMNA 4775/4885CNR2 26/4885
US-20090264435-A1 Novel Aryl- and Heteroarylpiperazines HRH3, HRH2, HRH4 SCD 3788/4885LMNA 4775/4885CNR2 26/4885

“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.