SCHEMBL3269282

SCHEMBL3269282

O=C(Nc1ccccc1)N1CCN(c2cccc(-c3cccc(F)c3F)c2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.60
MAPT P10636 4/20 0.60
HTT P42858 3/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
LMNA P02545 2/20 0.60
HCRTR1 O43613 1/20 0.60
USP2 O75604 1/20 0.60
CYP1A2 P05177 1/20 0.60
CYP3A4 P08684 1/20 0.60
CYP2C9 P11712 1/20 0.60
MAPK1 P28482 1/20 0.60
CYP2C19 P33261 1/20 0.60
GLA P06280 1/20 0.58
CA12 O43570 3/20 0.53
CA1 P00915 3/20 0.53
CA2 P00918 3/20 0.53
CA9 Q16790 3/20 0.53
ME2 P23368 1/20 0.53
ME1 P48163 1/20 0.53

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
SCHEMBL3275452 0.88 TRPV1 (0.52) POLBMAPTHTTMEN1KMT2A
SCHEMBL3268951 0.86 GLA (0.63) POLBMAPTHTTMEN1KMT2A
SCHEMBL3269311 0.81 FAAH (0.65) POLBMAPTHTTMEN1KMT2A
SCHEMBL3274584 0.81 FAAH (0.51) POLBMAPTHTTMEN1KMT2A
SCHEMBL3267735 0.81 CSNK1D (0.47) POLBMAPTHTTMEN1KMT2A
SCHEMBL3274874 0.80 DGAT1 (0.45) POLBMAPTHTTMEN1KMT2A
SCHEMBL3269574 0.79 DGAT1 (0.44) POLBMAPTHTTMEN1KMT2A
SCHEMBL13911678 0.78 MAPT (0.85) POLBMAPTHTTMEN1KMT2A
SCHEMBL3268200 0.77 ALDH1A1 (0.56) POLBMAPTHTTMEN1KMT2A
SCHEMBL3270402 0.76 PDK2 (0.53) MAPTLMNAUSP2CYP3A4NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100234389-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-16 US disclosed
US-20100234389-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-16 US disclosed
US-20100234389-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-16 US disclosed
EP-2199282-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-06-23 EP disclosed
US-20090163508-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-25 US disclosed
US-20090163508-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-25 US disclosed
US-20090163508-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-25 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 (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-20100234389-A1 AMIDE COMPOUND FAAH, FAAH2, NAAA POLB 4759/4885MAPT 3707/4885HTT 3560/4885
US-20090163508-A1 AMIDE COMPOUND FAAH, FAAH2, NAAA POLB 4759/4885MAPT 3707/4885HTT 3560/4885

“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.