SCHEMBL5176252

SCHEMBL5176252

CC(C)(C)c1ccc(CNC(=O)C(O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
CYP1A2 P05177 1/20 0.64
CYP2C19 P33261 1/20 0.64
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
CNR1 P21554 1/20 0.48
EPHX2 P34913 4/20 0.48
NR1H4 Q96RI1 3/20 0.48
HDAC3 O15379 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48

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
SCHEMBL5176623 1.00 MEN1 (0.64) MEN1KMT2ACYP1A2CYP2C19RAB9A
SCHEMBL5176858 0.86 TRPV1 (0.52) EPHX2NR1H4HDAC3HDAC8HDAC6
SCHEMBL5175444 0.86 MEN1 (0.64) MEN1KMT2ACYP1A2CYP2C19RAB9A
SCHEMBL5176114 0.86 BCHE (0.60) MEN1KMT2ARAB9AEPHX2NR1H4
SCHEMBL5176327 0.86 MEN1 (0.50) MEN1KMT2ACYP1A2CYP2C19
SCHEMBL5178124 0.85 MEN1 (0.63) MEN1KMT2ACYP1A2CYP2C19RAB9A
SCHEMBL9502670 0.81 MALT1 (0.55) MEN1KMT2ACYP1A2CYP2C19CNR1
SCHEMBL10766345 0.81 UTS2R (0.54) MEN1KMT2ACYP2C19RAB9ASMN1; SMN2
SCHEMBL30132781 0.81 MALT1 (0.55) MEN1KMT2ACYP1A2CYP2C19CNR1
SCHEMBL3942498 0.77 MEN1 (0.71) MEN1KMT2ACYP1A2CYP2C19RAB9A

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 MEN1 2604/4885KMT2A 3176/4885CYP1A2 156/4885

“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.