SCHEMBL15968627

SCHEMBL15968627

O=C(O)Nc1cnc(OCc2ccccc2)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.48
RORC P51449 1/20 0.47
SGMS2 Q8NHU3 3/20 0.45
NPC1 O15118 2/20 0.45
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
PPIA P62937 2/20 0.44
PDK1 Q15118 1/20 0.44
PDK2 Q15119 1/20 0.44
PDK3 Q15120 1/20 0.44
PDK4 Q16654 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CXCR2 P25025 1/20 0.43
RAB9A P51151 2/20 0.43
CTSV O60911 1/20 0.43
CTSL P07711 1/20 0.43
CASP3 P42574 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TAAR1 Q96RJ0 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
SCHEMBL12203142 0.78 MRGPRX4 (0.52) LRRK2SGMS2NPC1CTSVCTSL
SCHEMBL16164495 0.77 PIK3CA (0.44) MEN1KMT2AALDH1A1
SCHEMBL16165722 0.77 EGFR (0.41)
SCHEMBL30152295 0.76 EGFR (0.50) LRRK2SGMS2
SCHEMBL24969130 0.76 EGFR (0.50) LRRK2SGMS2
SCHEMBL112442 0.75 MGLL (0.55) NPC1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL15968824 0.75 RAB9A (0.41) LRRK2SGMS2NPC1CYP11B1CYP11B2
SCHEMBL30152279 0.74 SYK (0.47) LRRK2RORCSGMS2CXCR2
SCHEMBL15969101 0.74 MAOB (0.46) LRRK2LMNAALDH1A1
SCHEMBL2287859 0.74 SLC6A4 (0.56) MEN1KMT2ALMNAALDH1A1

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-9133129-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-15 US disclosed
EP-2772485-A1 BICYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-09-03 EP disclosed
US-20140243310-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-28 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 (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-20140243310-A1 BICYCLIC COMPOUND BICRA, NR3C2, CYP11B2 LRRK2 3218/4885RORC 74/4885SGMS2 730/4885

“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.