SCHEMBL5247753

SCHEMBL5247753

Cc1ccc(C(O)CO)s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.42
ALOX5 P09917 1/20 0.41
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TOP2A P11388 1/20 0.35
TOP2B Q02880 1/20 0.35
DAO P14920 1/20 0.34
PRMT6 Q96LA8 1/20 0.33
HSD17B2 P37059 1/20 0.33
DPP4 P27487 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TP53 P04637 2/20 0.31
MAPT P10636 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL9373399 0.83 ALOX5 (0.41) HTR1AALOX5KMT2AALDH1A1HPGD
SCHEMBL23258340 0.83 ALOX5 (0.41) HTR1AALOX5KMT2AALDH1A1HPGD
SCHEMBL23522265 0.78 HTR1A (0.42) HTR1AALOX5KMT2AALDH1A1HPGD
SCHEMBL15759881 0.77
SCHEMBL8077711 0.77 ALOX5 (0.46) HTR1AALOX5KMT2AALDH1A1HPGD
SCHEMBL31378997 0.76 ALOX5 (0.40) HTR1AALOX5KMT2AALDH1A1HPGD
SCHEMBL12847440 0.76 TP53 (0.42) HTR1AKMT2ACYP2C9CYP2C19TOP2A
SCHEMBL164188 0.76 ALOX5 (0.44) HTR1AALOX5KMT2AALDH1A1HPGD
SCHEMBL506265 0.75
SCHEMBL5247316 0.74 GABBR2 (0.43) TOP2ATOP2BDAOTP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1406605-B1 CARBAMATES OF 2-HETEROCYCLIC-1,2-ETHANEDIOLS SK CORP (KR) 2007-09-19 EP disclosed
EP-1406605-A4 CARBAMATES OF 2-HETEROCYCLIC-1,2-ETHANEDIOLS SK CORP (KR) 2005-10-26 EP disclosed
US-20050065193-A1 Carbamates of 2-heterocyclic-1,2-ethanediols SK CORPORATION 2005-03-24 US disclosed
US-6841569-B2 Carbamates of 2-heterocyclic-1,2-ethanediols SK CORPORATION (US) 2005-01-11 US disclosed
EP-1406605-A1 CARBAMATES OF 2-HETEROCYCLIC-1,2-ETHANEDIOLS SK Corporation (KR) 2004-04-14 EP disclosed
US-20030078235-A1 Carbamates of 2-heterocyclic-1,2-ethanediols SK BIOPHARMACEUTICALS CO., LTD. (KR) 2003-04-24 US disclosed
WO-2003000247-A1 CARBAMATES OF 2-HETEROCYCLIC-1,2-ETHANEDIOLS SK CORPORATION (KR) 2003-01-03 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 (2 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-20050065193-A1 Carbamates of 2-heterocyclic-1,2-ethanediols CNR2, CNR1, GRIN2C HTR1A 488/4885ALOX5 1146/4885KMT2A 1124/4885
US-20030078235-A1 Carbamates of 2-heterocyclic-1,2-ethanediols CNR2, CNR1, GRIN2C HTR1A 488/4885ALOX5 1146/4885KMT2A 1124/4885

“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.