SCHEMBL3766121

SCHEMBL3766121

O=C(O)N1CCC(c2nc(-c3ccc(F)cc3)cs2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 4/20 0.53
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ L3MBTL1 Q9Y468 4/20 0.50
▸ RAB9A P51151 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ FAAH O00519 2/20 0.50
▸ MAPK1 P28482 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ CYP3A4 P08684 2/20 0.49
▸ CYP2C9 P11712 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ LMNA P02545 3/20 0.47
▸ HTT P42858 2/20 0.47
▸ MAPT P10636 1/20 0.47
▸ HSD11B1 P28845 1/20 0.47
▸ POLB P06746 1/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ GAA P10253 1/20 0.44

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
SCHEMBL3763231 0.88 FAAH (0.61) TRPV1SMN1; SMN2L3MBTL1FAAHALDH1A1
SCHEMBL25168713 0.88 FAAH (0.51) TRPV1SMN1; SMN2L3MBTL1RAB9ANPC1
SCHEMBL2224640 0.87 TRPV1 (0.55) TRPV1SMN1; SMN2L3MBTL1RAB9ANPC1
SCHEMBL3774063 0.86 ALDH1A1 (0.49) TRPV1SMN1; SMN2FAAHALDH1A1MAPT
SCHEMBL3767361 0.83 ENPP2 (0.57) TRPV1SMN1; SMN2MAPK1LMNAHTT
SCHEMBL1287152 0.82 RAB9A (0.56) TRPV1SMN1; SMN2L3MBTL1RAB9ANPC1
SCHEMBL3770630 0.81 NPC1 (0.52) SMN1; SMN2L3MBTL1RAB9ANPC1FAAH
SCHEMBL2358755 0.79 HPGDS (0.66) L3MBTL1FAAHSCN9A
SCHEMBL18711879 0.79 FAAH (0.59) SMN1; SMN2L3MBTL1FAAHMAPK1ALDH1A1
SCHEMBL16612996 0.78 RARA (0.47) SMN1; SMN2L3MBTL1FAAHALDH1A1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7851473-B2 Amide compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-14 — — US disclosed
US-20080312226-A1 Amide Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-18 — — US disclosed
EP-1813606-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-08-01 — — EP 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 (1 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-20080312226-A1 Amide Compound FAAH, FAAH2, CNR2 TRPV1 87/4885SMN1; SMN2 2454/4885L3MBTL1 2773/4885

“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.

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