SCHEMBL18397952

SCHEMBL18397952

NC(=O)OCc1cc(=O)c2cc(-c3cn(-c4ccccc4)nn3)ccc2o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.49
▸ KEAP1 Q14145 1/20 0.39
▸ NFE2L2 Q16236 1/20 0.39
▸ HDAC3 O15379 3/20 0.38
▸ HDAC1 Q13547 2/20 0.38
▸ HDAC2 Q92769 2/20 0.38
▸ HDAC10 Q969S8 2/20 0.38
▸ HDAC8 Q9BY41 2/20 0.38
▸ HDAC6 Q9UBN7 2/20 0.38
▸ STIM1 Q13586 3/20 0.38
▸ ORAI1 Q96D31 3/20 0.38
▸ TSHR P16473 1/20 0.38
▸ CDC7 O00311 1/20 0.38
▸ OGT O15294 4/20 0.38
▸ NCOR2 Q9Y618 1/20 0.38
▸ HSD17B1 P14061 2/20 0.37
▸ HSD17B2 P37059 2/20 0.37
▸ EGLN1 Q9GZT9 1/20 0.37
▸ ABCG2 Q9UNQ0 1/20 0.37
▸ OPRD1 P41143 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
SCHEMBL18397854 0.85 LOXL2 (0.63) LOXL2KEAP1NFE2L2HDAC3HDAC1
Hydrochloric Acid SCHEMBL18397863 0.84 LOXL2 (0.65) LOXL2KEAP1NFE2L2HDAC3HDAC1
SCHEMBL20438089 0.79 LOXL2 (0.43) LOXL2HDAC3HDAC1HDAC2HDAC10
SCHEMBL18397886 0.77 LOXL2 (0.53) LOXL2KEAP1NFE2L2HDAC3HDAC1
Hydrochloric Acid SCHEMBL18397934 0.76 LOXL2 (0.54) LOXL2KEAP1NFE2L2HDAC3HDAC1
SCHEMBL18397944 0.75 EGLN1 (0.42) LOXL2KEAP1NFE2L2HDAC3HDAC1
SCHEMBL18397876 0.73 PIM1 (0.48) LOXL2
SCHEMBL1976012 0.73 KDM4E (0.53) LOXL2TSHRSIGMAR1NPC1
SCHEMBL18397764 0.72 PRMT5 (0.43) LOXL2NPC1
SCHEMBL31605003 0.72 STIM1 (0.45) KEAP1NFE2L2HDAC3HDAC1HDAC2

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-20180215727-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. 2018-08-02 — — US disclosed
EP-3325462-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF Pharmakea, Inc. (US) 2018-05-30 — — EP disclosed
WO-2017015221-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. (US) 2017-01-26 — — 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-20180215727-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF LOXL2, LOXL1, LOX LOXL2 1/4885KEAP1 940/4885NFE2L2 530/4885

“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.

Send feedback