SCHEMBL5178374

SCHEMBL5178374

CCCC(C)(C)c1ccc(C(=O)OC)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.54
MAPT P10636 2/20 0.53
CA1 P00915 4/20 0.50
CA2 P00918 4/20 0.50
TDP1 Q9NUW8 1/20 0.48
CA12 O43570 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
LOXL2 Q9Y4K0 1/20 0.47
HPGD P15428 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TSHR P16473 1/20 0.46
CNR1 P21554 1/20 0.45
ALDH1A1 P00352 1/20 0.44
NPC1 O15118 1/20 0.44
CASP1 P29466 1/20 0.44
RAB9A P51151 1/20 0.44
NOTUM Q6P988 1/20 0.44

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
SCHEMBL1794289 0.86 MAPT (0.56) MAPTCA1CA2TDP1CA12
SCHEMBL19177191 0.83 MAPT (0.50) CNR2MAPTCA1CA2TDP1
SCHEMBL11190657 0.82 MAPT (0.56) MAPTCA1CA2TDP1CA12
SCHEMBL9206445 0.81 MAPT (0.51) CNR2MAPTCA1CA2TDP1
SCHEMBL18517387 0.81 CNR2 (0.53) CNR2CA1CA2CA12CA9
SCHEMBL13418577 0.81 MAPT (0.55) MAPTCA1CA2TDP1CA12
SCHEMBL13144227 0.81 MAPT (0.55) MAPTCA1CA2TDP1CA12
SCHEMBL4446216 0.81 MAPT (0.59) MAPTCA1CA2TDP1CA12
SCHEMBL5177528 0.80 SRD5A2 (0.53) MAPTTDP1MEN1KMT2ATSHR
SCHEMBL14493278 0.80 ALDH1A1 (0.70) MAPTCA1CA2TDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7259183-B2 Indole, indazole and indoline derivatives as CETP inhibitors HOFFMANN-LA ROCHE INC. (US) 2007-08-21 US disclosed
EP-1776338-A1 INDOLE, INDAZOLE OR INDOLINE DERIVATIVES F. Hoffmann-Roche AG (CH) 2007-04-25 EP disclosed
US-20060030613-A1 Indole, indazole and indoline derivatives as CETP inhibitors F. HOFFMANN-LA ROCHE AG (CH) 2006-02-09 US disclosed
WO-2006013048-A1 INDOLE, INDAZOLE OR INDOLINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2006-02-09 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-20060030613-A1 Indole, indazole and indoline derivatives as CETP inhibitors CETP, NAT1, MTTP CNR2 317/4885MAPT 1559/4885CA1 4376/4885

“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.