SCHEMBL18362021

SCHEMBL18362021

NCc1cc(Oc2cccc3c2ccn3Cc2ccccc2)ncn1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 7/20 0.61
▸ HTR6 P50406 4/20 0.49
▸ MAP2K7 O14733 1/20 0.38
▸ ERBB2 P04626 2/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ APP P05067 1/20 0.38
▸ SLC2A1 P11166 1/20 0.38
▸ MPO P05164 1/20 0.38
▸ KLKB1 P03952 1/20 0.37
▸ KLK1 P06870 1/20 0.37

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
Hydrochloric Acid SCHEMBL20337895 0.99 LOXL2 (0.60) LOXL2HTR6MAP2K7ERBB2DRD2
SCHEMBL18362163 0.88 LOXL2 (0.61) LOXL2HTR6
SCHEMBL18361824 0.85 LOXL2 (0.64) LOXL2HTR6MPO
SCHEMBL18362032 0.84 LOXL2 (0.59) LOXL2HTR6
SCHEMBL18361822 0.84 LOXL2 (0.74) LOXL2
Trifluoroacetic Acid SCHEMBL20337875 0.84 LOXL2 (0.56) LOXL2HTR6
SCHEMBL18049191 0.83 LOXL2 (0.52) LOXL2HTR6MPOKLKB1KLK1
SCHEMBL18361807 0.83 LOXL2 (0.65) LOXL2ERBB2
Hydrochloric Acid SCHEMBL18049098 0.83 LOXL2 (0.52) LOXL2HTR6KLKB1KLK1
Acetic Acid SCHEMBL20337861 0.82 LOXL2 (0.66) LOXL2MAP2K7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180186755-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA INC (US) 2018-07-05 — — US claimed
EP-3510404-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF Pharmakea, Inc. (US) 2019-07-17 — — EP disclosed
US-20190192697-A1 CHEMICAL PROBES OF LYSYL OXIDASK-LIKE 2 AND USES THEREOF PHARMAKEA, INC. 2019-06-27 — — US disclosed
US-20180186755-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA INC (US) 2018-07-05 — — US disclosed
US-20180186755-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA INC (US) 2018-07-05 — — US disclosed
US-20180186755-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA INC (US) 2018-07-05 — — US disclosed
WO-2018048928-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF PHARMAKEA, INC. (US) 2018-03-15 — — WO disclosed
WO-2017003862-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. (US) 2017-01-05 — — WO disclosed
US-9109103-B2 Functionalized polymer, rubber composition and pneumatic tire THE GOODYEAR TIRE & RUBBER COMPANY (US) 2015-08-18 — — 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 (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-20180186755-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF LOXL2, LOXL1, LOX LOXL2 1/4885HTR6 2732/4885MAP2K7 4203/4885
US-20190192697-A1 CHEMICAL PROBES OF LYSYL OXIDASK-LIKE 2 AND USES THEREOF LOXL2, LOXL1, LOXL3 LOXL2 1/4885HTR6 2899/4885MAP2K7 3114/4885

“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.

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