SCHEMBL6796993

SCHEMBL6796993

O=Cc1ccccc1C(=O)OC(C(=O)O)C(OC(=O)c1ccccc1C=O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
TP53 P04637 1/20 0.56
LMNA P02545 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
CYP2D6 P10635 2/20 0.41
TRIM24 O15164 1/20 0.39
TRIM33 Q9UPN9 1/20 0.39
RECQL P46063 1/20 0.39
GAA P10253 1/20 0.38
SRC P12931 2/20 0.36
ALDH1A1 P00352 4/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALOX15 P16050 1/20 0.35

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
SCHEMBL2222781 0.82 NPC1 (0.51) TSHRTP53LMNAKMT2AMEN1
SCHEMBL6304130 0.80 HCAR2 (0.50) TSHRTP53LMNAKMT2AMEN1
Benzene SCHEMBL28217563 0.78 TSHR (0.55) TSHRLMNAKMT2ATDP1ALDH1A1
SCHEMBL11395358 0.78 LMNA (0.44) TSHRLMNAKMT2AMEN1THRB
SCHEMBL6199923 0.77 LMNA (0.48) TSHRLMNAKMT2AMEN1THRB
SCHEMBL14039520 0.77 ALDH1A1 (0.46) TSHRLMNAKMT2AGAAALDH1A1
SCHEMBL9099494 0.77 LMNA (0.41) LMNAKMT2AMEN1THRBBLM
SCHEMBL1092957 0.77 SCN1A (0.44) TSHRLMNAKMT2AMEN1THRB
SCHEMBL3545045 0.76 TP53 (0.58) TSHRTP53LMNAKMT2ARECQL
SCHEMBL4179476 0.76 TSHR (0.58) TSHRTP53LMNAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040039206-A1 Process for resolving racemic mixtures of piperidine derivatives MOHER ERIC DAVID (US) 2004-02-26 US disclosed
EP-1341762-A1 PROCESS FOR RESOLVING RACEMIC MIXTURES OF PIPERIDINE DERIVATIVES ELI LILLY AND COMPANY (US) 2003-09-10 EP disclosed
WO-2002068391-A1 PROCESS FOR RESOLVING RACEMIC MIXTURES OF PIPERIDINE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-09-06 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-20040039206-A1 Process for resolving racemic mixtures of piperidine derivatives SRR, OPRM1, SRM TSHR 2004/4885TP53 4127/4885LMNA 1605/4885

“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.