SCHEMBL3767910

SCHEMBL3767910

Fc1ccc(-c2csc(N3CCNCC3)n2)c(F)c1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.58
FAAH O00519 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.48
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MAOA P21397 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MAOB P27338 4/20 0.44
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
Hydrochloric Acid SCHEMBL3766096 0.99 AR (0.57) ARFAAHL3MBTL1NPC1RAB9A
SCHEMBL1259386 0.84 SMN1; SMN2 (0.61) ARFAAHL3MBTL1NPC1RAB9A
SCHEMBL194798 0.81 L3MBTL1 (0.72) ARL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL3774648 0.80 FAAH (0.62) ARFAAHL3MBTL1NPC1RAB9A
Hydrochloric Acid SCHEMBL3766425 0.80 L3MBTL1 (0.70) ARL3MBTL1NPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL3777109 0.80 L3MBTL1 (0.70) ARL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL15269497 0.79 AR (0.52) ARFAAHL3MBTL1NPC1RAB9A
SCHEMBL3765936 0.79 AR (0.56) ARFAAHL3MBTL1NPC1RAB9A
SCHEMBL3759712 0.79 MAPT (0.54) ARFAAHL3MBTL1NPC1RAB9A
SCHEMBL18204121 0.78 AR (0.54) ARNPC1RAB9ASMN1; SMN2ALDH1A1

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 AR 2900/4885FAAH 1/4885L3MBTL1 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.