SCHEMBL14729677

SCHEMBL14729677

Fc1ccc(-c2cc(OCc3ccccc3)c(OCc3ccccc3)nn2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
POLB P06746 2/20 0.45
MAPT P10636 4/20 0.43
LMNA P02545 3/20 0.43
HTT P42858 2/20 0.43
SQOR Q9Y6N5 1/20 0.43
STAT3 P40763 1/20 0.43
DHODH Q02127 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
PTGER1 P34995 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 3/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAPK14 Q16539 2/20 0.41
MAPK13 O15264 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
SCHEMBL14729707 0.90 SQOR (0.51) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL14729696 0.86 MAOB (0.43) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL14729690 0.86 EGFR (0.45) MAPTLMNASQORDHODHL3MBTL1
SCHEMBL14729734 0.86 CNR1 (0.47) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL14729701 0.83 MEN1 (0.46) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL14729697 0.83 SRC (0.41) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL14729659 0.83 KMO (0.42) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL14729755 0.83 MEN1 (0.46) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL14729732 0.82 MAOB (0.54) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL14729658 0.82 PPIA (0.43) NPC1MAPTLMNAL3MBTL1PTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130052281-A1 NOVEL COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-28 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-20130052281-A1 NOVEL COMPOUNDS ABCG2, F12, UGT1A1 SMN1; SMN2 1317/4885NPC1 76/4885RAB9A 588/4885

“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.