SCHEMBL18615588

SCHEMBL18615588

N[C@H]1CC[C@H](Oc2ccnc(Cl)n2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOX P28300 1/20 0.38
▸ LOXL2 Q9Y4K0 1/20 0.38
▸ CACNB4 O00305 1/20 0.36
▸ CACNA1A O00555 1/20 0.36
▸ CACNA1G O43497 1/20 0.36
▸ CACNG3 O60359 1/20 0.36
▸ CACNA1F O60840 1/20 0.36
▸ CACNA1H O95180 1/20 0.36
▸ CACNB3 P54284 1/20 0.36
▸ CACNA2D1 P54289 1/20 0.36
▸ CACNG7 P62955 1/20 0.36
▸ CACNA1B Q00975 1/20 0.36
▸ CACNA1D Q01668 1/20 0.36
▸ CACNB1 Q02641 1/20 0.36
▸ CACNG1 Q06432 1/20 0.36
▸ CACNB2 Q08289 1/20 0.36
▸ CACNA1S Q13698 1/20 0.36
▸ CACNA1C Q13936 1/20 0.36
▸ CACNA1E Q15878 1/20 0.36
▸ CACNA2D4 Q7Z3S7 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
Hydrochloric Acid SCHEMBL20357423 0.98 LOX (0.37) LOXLOXL2CACNB4CACNA1ACACNA1G
Hydrochloric Acid SCHEMBL20357422 0.98 LOX (0.37) LOXLOXL2CACNB4CACNA1ACACNA1G
SCHEMBL22576465 0.91 MALT1 (0.39) LOXLOXL2MALT1ROCK1ALOX5AP
SCHEMBL19510752 0.84 LOX (0.44) LOXLOXL2MALT1ROCK1ALOX5AP
SCHEMBL22895345 0.84 LOX (0.47) LOXLOXL2MALT1ALOX5APFEN1
SCHEMBL15577842 0.80 HDAC6 (0.45) CACNB4CACNA1ACACNA1GCACNG3CACNA1F
SCHEMBL18615460 0.78 LRRK2 (0.43) LOXLOXL2SYKLRRK2MAPKAPK2
SCHEMBL25307709 0.78 DGAT1 (0.44) KMOKCNH2
SCHEMBL25307708 0.78 DGAT1 (0.44) KMOKCNH2
Hydrochloric Acid SCHEMBL20357242 0.77 LRRK2 (0.42) LOXLOXL2SYKLRRK2MAPKAPK2

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
EP-3345893-B1 UREA DERIVATIVE AND USE THEREFOR TORAY INDUSTRIES (JP) 2019-10-30 — — EP disclosed
US-10280145-B2 Urea derivative and use therefor TORAY INDUSTRIES, INC. (JP) 2019-05-07 — — US disclosed
EP-3345893-A1 UREA DERIVATIVE AND USE THEREFOR Toray Industries, Inc. (JP) 2018-07-11 — — EP disclosed
WO-2017038873-A1 UREA DERIVATIVE AND USE THEREFOR 東レ株式会社 2017-03-09 — — 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-10280145-B2 Urea derivative and use therefor UTS2R, DDR1, WEE1 LOX 4218/4885LOXL2 2869/4885CACNB4 4549/4885

“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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