SCHEMBL670411

SCHEMBL670411

CCCCc1nc(C)n(-c2ccc(OCc3ccccc3)cc2)c(=O)c1Cc1cc(CCC)c(Oc2ccccc2)c(CCC)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
PKM P14618 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HRH3 Q9Y5N1 10/20 0.40
KCNH2 Q12809 4/20 0.37
POLB P06746 1/20 0.37
ADRA1A P35348 1/20 0.37
CCR2 P41597 1/20 0.36
CCR5 P51681 1/20 0.36
TDP2 O95551 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL660726 0.90 L3MBTL1 (0.46) NPC1RAB9AL3MBTL1PKMSMN1; SMN2
SCHEMBL666743 0.89 NPC1 (0.40) NPC1RAB9AL3MBTL1PKMSMN1; SMN2
SCHEMBL661735 0.86 PPARG (0.44) NPC1RAB9AL3MBTL1
SCHEMBL666742 0.85 PPARG (0.39) NPC1RAB9AL3MBTL1PKMSMN1; SMN2
SCHEMBL661833 0.82 APLNR (0.35) HRH3LMNAMAPK1
SCHEMBL667884 0.81 TP53 (0.34) SMN1; SMN2HRH3KCNH2CCR2CCR5
SCHEMBL665635 0.80 PPARD (0.36) HRH3KCNH2LMNAMAPK1
SCHEMBL660776 0.80 CACNA2D1 (0.40) NPC1RAB9APKMSMN1; SMN2HRH3
SCHEMBL661745 0.80 PPARG (0.45)
SCHEMBL671035 0.79 KDM4E (0.38) SMN1; SMN2POLBCCR2

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-20120046308-A1 NOVEL ALPHA-PHENOXYBENZENEACETIC ACID DERIVATIVE AND PHARMACEUTICAL PREPARATION COMPRISING SAME KOWA COMPANY, LTD. (JP) 2012-02-23 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-20120046308-A1 NOVEL ALPHA-PHENOXYBENZENEACETIC ACID DERIVATIVE AND PHARMACEUTICAL PREPARATION COMPRISING SAME PPARA, PPARG, PPARD NPC1 1827/4885RAB9A 845/4885L3MBTL1 3923/4885

“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.