SCHEMBL3485349

SCHEMBL3485349

CC(Nc1ncc(-c2ccc3c(c2)OCCO3)cc1O)C(=O)N(C)C

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
CHEK1 O14757 1/20 0.42
CHEK2 O96017 1/20 0.42
SYK P43405 1/20 0.39
TSHR P16473 1/20 0.38
MAPT P10636 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSP90AA1 P07900 2/20 0.37
VNN1 O95497 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
OGA O60502 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL3485262 0.87 SYK (0.51) ALOX5CHEK1CHEK2SYKTSHR
SCHEMBL3484720 0.86 ALOX5 (0.45) ALOX5CHEK1CHEK2SYKTSHR
SCHEMBL3485346 0.83 ALOX5 (0.42) ALOX5CHEK1CHEK2TSHRNPC1
SCHEMBL14331179 0.80 EGLN1 (0.44) CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL3484992 0.80 ALOX5 (0.45) ALOX5CHEK1CHEK2MAPTNPC1
SCHEMBL3485538 0.79 ALOX5 (0.44) ALOX5CHEK1CHEK2MAPTVNN1
SCHEMBL3484712 0.77 VEGFA (0.47) ALOX5MAPTNPC1RAB9AMEN1
SCHEMBL3484920 0.76 CHEK2 (0.50) ALOX5CHEK1CHEK2SYKTSHR
SCHEMBL3485270 0.74 GRIN2B (0.47)
SCHEMBL3485024 0.74 CHEK2 (0.48) ALOX5CHEK1CHEK2SYKTSHR

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-20160009648-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE KREOS CAPITAL VII (UK) LIMITED (GB) 2016-01-14 US claimed
US-8343952-B2 Prolyl hydroxylase inhibitors and methods of use AKEBIA THERAPEUTICS INC. (US) 2013-01-01 US claimed
US-20100331303-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE AKEBIA THERAPEUTICS, INC. 2010-12-30 US claimed

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-20160009648-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE HIF1AN, EGLN3, HIF1A ALOX5 624/4885CHEK1 3883/4885CHEK2 4502/4885
US-20100331303-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE HIF1AN, EGLN3, HIF1A ALOX5 624/4885CHEK1 3883/4885CHEK2 4502/4885

“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.