SCHEMBL4741015

SCHEMBL4741015

Cc1cccc(C(=O)OCc2ccccc2)c1-c1ccc(C(C)(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
TDP1 Q9NUW8 3/20 0.48
L3MBTL1 Q9Y468 3/20 0.46
TSHR P16473 3/20 0.46
MAPK1 P28482 2/20 0.46
CYP3A4 P08684 1/20 0.46
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
AR P10275 1/20 0.45
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
POLB P06746 1/20 0.42
KMT2A Q03164 2/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A3 Q01959 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
KDM4E B2RXH2 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
SCHEMBL7863113 0.88 ALDH1A1 (0.58) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL28189433 0.81 MAPT (0.54) ALDH1A1TDP1L3MBTL1RAB9APOLB
SCHEMBL4157627 0.80 POLB (0.56) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL4785732 0.79 MYC (0.51) ALDH1A1MAPK1PPARGPPARAKDM4E
SCHEMBL21264504 0.77 ALDH1A1 (0.48) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL2705753 0.77 ALDH1A1 (0.69) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL29353285 0.77 ALDH1A1 (0.69) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL27530304 0.76 ALDH1A1 (0.59) ALDH1A1TDP1L3MBTL1TSHRMAPK1
SCHEMBL18320469 0.76 KMT2A (0.69) ALDH1A1TDP1L3MBTL1RAB9ANPC1
SCHEMBL17971091 0.76 ALDH1A1 (0.63) ALDH1A1TDP1L3MBTL1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249130-A1 Gut microsomal triglyceride transport protein inhibitors SIRTRIS PHARMACEUTICALS, INC. (US) 2008-10-09 US disclosed
US-20080249130-A1 Gut microsomal triglyceride transport protein inhibitors SIRTRIS PHARMACEUTICALS, INC. (US) 2008-10-09 US disclosed
US-20080249130-A1 Gut microsomal triglyceride transport protein inhibitors SIRTRIS PHARMACEUTICALS, INC. (US) 2008-10-09 US disclosed
WO-2008100423-A1 GUT MICROSOMAL TRIGLYCERIDE TRANSPORT PROTEIN INHIBITORS SIRTRIS PHARMACEUTICALS, INC. (US) 2008-08-21 WO disclosed
WO-2008100423-A1 GUT MICROSOMAL TRIGLYCERIDE TRANSPORT PROTEIN INHIBITORS SIRTRIS PHARMACEUTICALS, INC. (US) 2008-08-21 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-20080249130-A1 Gut microsomal triglyceride transport protein inhibitors MTTP, CETP, FABP2 ALDH1A1 983/4885TDP1 2015/4885L3MBTL1 3607/4885

“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.