SCHEMBL2723239

SCHEMBL2723239

CCOc1ccc(Br)cc1C(=O)OC

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
HTT P42858 2/20 0.56
SMN1; SMN2 Q16637 3/20 0.54
HSD17B10 Q99714 2/20 0.52
TDP1 Q9NUW8 2/20 0.51
PTGDR2 Q9Y5Y4 2/20 0.51
HPGD P15428 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
RXFP1 Q9HBX9 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
POLB P06746 1/20 0.51
TSHR P16473 2/20 0.48
NR4A2 P43354 1/20 0.47
KMT2A Q03164 1/20 0.46
AR P10275 1/20 0.46
GAA P10253 1/20 0.46
LMNA P02545 2/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL4600210 0.88 HPGD (0.51) ALDH1A1HTTSMN1; SMN2HSD17B10PTGDR2
SCHEMBL4601189 0.87 PTGDR2 (0.51) ALDH1A1SMN1; SMN2HSD17B10TDP1PTGDR2
SCHEMBL16055509 0.87 TDP1 (0.62) ALDH1A1HTTSMN1; SMN2HSD17B10TDP1
SCHEMBL2772497 0.86 SMN1; SMN2 (0.49) ALDH1A1HTTSMN1; SMN2HSD17B10PTGDR2
SCHEMBL15912482 0.86 PTGDR2 (0.53) ALDH1A1HTTSMN1; SMN2HSD17B10PTGDR2
SCHEMBL3388835 0.85 TSHR (0.62) SMN1; SMN2HSD17B10PTGDR2HPGDNPSR1
SCHEMBL13064184 0.83 PTGDR2 (0.71) HTTSMN1; SMN2HSD17B10PTGDR2HPGD
SCHEMBL16997485 0.83 HSD17B10 (0.49) ALDH1A1HTTSMN1; SMN2HSD17B10PTGDR2
SCHEMBL30361998 0.83 ALDH1A1 (0.59) ALDH1A1HTTSMN1; SMN2HSD17B10TDP1
SCHEMBL392403 0.83 ALDH1A1 (0.59) ALDH1A1HTTSMN1; SMN2HSD17B10TDP1

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
WO-2021060281-A1 PROSTAGLANDIN E2 RECEPTOR EP2/EP4 DUAL ANTAGONIST AGC株式会社 2021-04-01 WO disclosed
US-9776976-B2 Triazolone compounds and uses thereof INCEPTION 2, INC. (US) 2017-10-03 US disclosed
EP-3041826-A1 TRIAZOLONE COMPOUNDS AND USES THEREOF Inception 2, Inc. (US) 2016-07-13 EP disclosed
US-20160194292-A1 TRIAZOLONE COMPOUNDS AND USES THEREOF TEMPEST THERAPEUTICS, INC. 2016-07-07 US disclosed
CN-105579440-A Triazolone compounds and uses thereof INCEPTION 2 INC 2016-05-11 CN disclosed
WO-2015035059-A1 TRIAZOLONE COMPOUNDS AND USES THEREOF INCEPTION 2, INC. (US) 2015-03-12 WO disclosed
WO-2012051708-A1 ANTI-BACTERIAL PYRUVATE KINASE MODULATOR COMPOUNDS, COMPOSITIONS, USES, AND METHODS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2012-04-26 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-20160194292-A1 TRIAZOLONE COMPOUNDS AND USES THEREOF PPARA, PPARD, PPARG ALDH1A1 497/4885HTT 3704/4885SMN1; SMN2 2965/4885

“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.