SCHEMBL3268403

SCHEMBL3268403

O=C(Nc1ccc(F)nc1)N1CCN(c2ccnc(-c3cccc(F)c3F)n2)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 10/20 0.53
FAAH O00519 3/20 0.53
DGAT1 O75907 2/20 0.44
POLB P06746 1/20 0.43
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 1/20 0.41
JAK2 O60674 1/20 0.41
FLT3 P36888 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL3268546 0.89 FAAH (0.53) TRPV1FAAHKDM4EALDH1A1MAPT
SCHEMBL3272018 0.81 FAAH (0.75) TRPV1FAAH
SCHEMBL3272241 0.78 FAAH (0.48) TRPV1FAAHDGAT1ALDH1A1
SCHEMBL3269000 0.77 FAAH (0.71) TRPV1FAAHALDH1A1PKM
SCHEMBL13164638 0.76 FAAH (0.48) TRPV1FAAHDGAT1
SCHEMBL3268823 0.76 FAAH (0.46) TRPV1FAAHDGAT1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL3270569 0.76 FAAH (0.70) TRPV1FAAHALDH1A1PKM
SCHEMBL13164634 0.76 FAAH (0.46) TRPV1FAAHDGAT1KDM4EALDH1A1
SCHEMBL3267793 0.75 FAAH (0.53) TRPV1FAAHKDM4EALDH1A1
SCHEMBL3269212 0.75 FAAH (0.53) TRPV1FAAH

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 TRPV1 6/4885FAAH 1/4885DGAT1 256/4885
US-20090163508-A1 AMIDE COMPOUND FAAH, FAAH2, NAAA TRPV1 6/4885FAAH 1/4885DGAT1 256/4885

“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.