SCHEMBL4174639

SCHEMBL4174639

COc1ccc(-c2cccc(C(=O)Nc3cccc(C(=O)O)c3)c2)c(OC)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.74
RAB9A P51151 5/20 0.74
MEN1 O00255 3/20 0.74
KMT2A Q03164 3/20 0.74
SMN1; SMN2 Q16637 3/20 0.74
NR1H4 Q96RI1 2/20 0.62
POLB P06746 2/20 0.61
CYP1A2 P05177 1/20 0.60
CYP3A4 P08684 1/20 0.60
RXFP1 Q9HBX9 1/20 0.59
KCNK9 Q9NPC2 2/20 0.58
KCNK3 O14649 1/20 0.58
MITF O75030 1/20 0.58
ALDH1A1 P00352 1/20 0.58
MAPT P10636 1/20 0.58
TSHR P16473 1/20 0.58
NLRP3 Q96P20 1/20 0.57
TP53 P04637 1/20 0.57
FABP1 P07148 1/20 0.57
TRPV1 Q8NER1 1/20 0.56

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
SCHEMBL4186005 0.91 SMN1; SMN2 (0.71) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL4171948 0.89 CYP2C8 (0.69) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL13639753 0.84 RXFP1 (0.62) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL23070447 0.84 RAB9A (0.81) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2907086 0.83 HSP90AA1 (0.65) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL23070455 0.81 KCNK9 (0.83) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL4165226 0.80 SELL (0.69) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL4174870 0.80 CYP1A2 (0.67) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL6300804 0.80 POLB (0.67) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL7828529 0.80 RAB9A (0.75) NPC1RAB9AMEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948146-B1 NOVEL MULTI-CYCLIC COMPOUNDS AND THEIR USE REVOTAR BIOPHARMACEUTICALS AG (DE) 2012-11-07 EP disclosed
EP-1948146-B1 NOVEL MULTI-CYCLIC COMPOUNDS AND THEIR USE REVOTAR BIOPHARMACEUTICALS AG (DE) 2012-11-07 EP disclosed
US-20090030015-A1 NOVEL MULTI-CYCLIC COMPOUNDS REVOTAR BIOPHARMACEUTICALS AG (DE) 2009-01-29 US disclosed
US-20090030015-A1 NOVEL MULTI-CYCLIC COMPOUNDS REVOTAR BIOPHARMACEUTICALS AG (DE) 2009-01-29 US disclosed
US-20090030015-A1 NOVEL MULTI-CYCLIC COMPOUNDS REVOTAR BIOPHARMACEUTICALS AG (DE) 2009-01-29 US disclosed
EP-1948146-A2 NOVEL MULTI-CYCLIC COMPOUNDS AND THEIR USE Revotar Biopharmaceuticals AG (DE) 2008-07-30 EP disclosed
WO-2007039111-A2 NOVEL MULTI-CYCLIC COMPOUNDS AND THEIR USE REVOTAR BIOPHARMACEUTICALS AG (DE) 2007-04-12 WO disclosed
WO-2007039111-A2 NOVEL MULTI-CYCLIC COMPOUNDS AND THEIR USE REVOTAR BIOPHARMACEUTICALS AG (DE) 2007-04-12 WO 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-20090030015-A1 NOVEL MULTI-CYCLIC COMPOUNDS SELP, SELE, SELL NPC1 1102/4885RAB9A 2400/4885MEN1 3851/4885

“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.