SCHEMBL4513254

SCHEMBL4513254

Cc1ccccc1CN1CCCC1=O

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.64
MAPK1 P28482 1/20 0.64
MAPT P10636 1/20 0.63
MEN1 O00255 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.53
P2RX7 Q99572 1/20 0.52
ADRA1B P35368 2/20 0.52
ADRA1D P25100 1/20 0.52
ADRA1A P35348 1/20 0.52
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
TRPC5 Q9UL62 1/20 0.48
CYP2A13 Q16696 1/20 0.46
ADORA2A P29274 1/20 0.46
ACHE P22303 1/20 0.46

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
SCHEMBL4515572 0.83 MAPT (0.67) KMT2AMAPTMEN1SMN1; SMN2P2RX7
SCHEMBL14537170 0.80 MAPK1 (0.56) KMT2AMAPK1MAPTL3MBTL1ADRA1B
SCHEMBL14458691 0.80 L3MBTL1 (0.53) KMT2AMAPK1L3MBTL1CYP2A13ADORA2A
SCHEMBL5195011 0.80 ALDH1A1 (0.58) KMT2AMAPK1MAPTSMN1; SMN2L3MBTL1
SCHEMBL5473675 0.80 MPO (0.53) KMT2AMAPK1MEN1L3MBTL1ADRA1B
SCHEMBL7484195 0.80 ACHE (0.68) KMT2AMEN1L3MBTL1ADRA1DADRA1A
SCHEMBL4512688 0.79 KMT2A (0.65) KMT2AMAPTMEN1SMN1; SMN2P2RX7
SCHEMBL20475318 0.78 KMT2A (0.58) KMT2AMAPK1MAPTMEN1SMN1; SMN2
SCHEMBL4525195 0.78 MAPT (1.00) KMT2AMAPTMEN1SMN1; SMN2P2RX7
SCHEMBL1237529 0.78 MTNR1A (0.50) KMT2AMAPK1L3MBTL1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
US-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-22 US disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 EP disclosed
EP-1864971-A1 PROPHYLACTIC/THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-12-12 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-20090264650-A1 Prophylactic/Therapeutic Agent for Diabetes HSD11B1, HSD17B1, HSD11B2 KMT2A 2379/4885MAPK1 463/4885MAPT 4692/4885

“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.