SCHEMBL16428951

SCHEMBL16428951

NC(=O)c1ccc(O)c(-c2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.54
CHEK2 O96017 3/20 0.49
MKNK1 Q9BUB5 2/20 0.49
MKNK2 Q9HBH9 1/20 0.49
BCAT2 O15382 2/20 0.48
HSD17B10 Q99714 2/20 0.48
PARP1 P09874 2/20 0.48
POLB P06746 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
TSHR P16473 1/20 0.48
CYP2C19 P33261 1/20 0.48
RECQL P46063 1/20 0.48
BLM P54132 1/20 0.48
PMP22 Q01453 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ERN1 O75460 2/20 0.47
DHODH Q02127 2/20 0.47
LCK P06239 1/20 0.47

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
SCHEMBL8658097 0.85 BACE1 (0.58) BACE1HSD17B10MAPTTDP1L3MBTL1
SCHEMBL901046 0.85 BACE1 (0.58) BACE1HSD17B10POLBMAPTL3MBTL1
SCHEMBL29772126 0.85 BACE1 (0.58) BACE1HSD17B10POLBMAPTL3MBTL1
SCHEMBL30903715 0.85 L3MBTL1 (0.52) CHEK2MKNK1MKNK2BCAT2HSD17B10
SCHEMBL2026663 0.85 L3MBTL1 (0.52) CHEK2MKNK1MKNK2BCAT2HSD17B10
Hydrochloric Acid SCHEMBL28812686 0.83 CHEK2 (0.50) CHEK2MKNK1MKNK2BCAT2HSD17B10
SCHEMBL10479736 0.83 BACE1 (0.56) BACE1HSD17B10POLBMAPTL3MBTL1
SCHEMBL11407852 0.82 BACE1 (0.46) BACE1CHEK2MKNK1MKNK2BCAT2
SCHEMBL3221434 0.81 EGFR (0.58) BACE1HSD17B10POLBMAPTL3MBTL1
SCHEMBL9511744 0.81 MAPT (0.57) BACE1HSD17B10MAPTALDH1A1HPGD

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-10799510-B2 Derivatives of 6-substituted triazolopyridazines as Rev-Erb agonists GENFIT (FR) 2020-10-13 US disclosed
US-20170296548-A1 DERIVATIVES OF 6-SUBSTITUTED TRIAZOLOPYRIDAZINES AS REV-ERB AGONISTS GENFIT (FR) 2017-10-19 US disclosed
US-9586963-B2 Derivatives of 6-substituted triazolopyridazines as Rev-Erb agonists GENFIT (FR) 2017-03-07 US disclosed
US-20150038503-A1 DERIVATIVES OF 6-SUBSTITUTED TRIAZOLOPYRIDAZINES AS REV-ERB AGONISTS GENFIT (FR) 2015-02-05 US 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 (3 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-10799510-B2 Derivatives of 6-substituted triazolopyridazines as Rev-Erb agonists NR1D1, NR1D2, PER2 BACE1 2625/4885CHEK2 3225/4885MKNK1 646/4885
US-20170296548-A1 DERIVATIVES OF 6-SUBSTITUTED TRIAZOLOPYRIDAZINES AS REV-ERB AGONISTS NR1D1, NR1D2, PER2 BACE1 2625/4885CHEK2 3225/4885MKNK1 646/4885
US-20150038503-A1 DERIVATIVES OF 6-SUBSTITUTED TRIAZOLOPYRIDAZINES AS REV-ERB AGONISTS NR1D1, NR1D2, PER2 BACE1 2625/4885CHEK2 3225/4885MKNK1 646/4885

“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.