SCHEMBL20699533

SCHEMBL20699533

Cc1cc(-c2c(C)n(C/C(F)=C/C(N)Cl)c3ccc([N+](=O)[O-])cc23)cc(C)n1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RAD52 P43351 1/20 0.43
▸ PLA2G2A P14555 1/20 0.40
▸ LOXL2 Q9Y4K0 12/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ DAO P14920 2/20 0.38
▸ AOC3 Q16853 2/20 0.38
▸ F2RL3 Q96RI0 2/20 0.38
▸ F2R P25116 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ LOX P28300 1/20 0.37
▸ LOXL3 P58215 1/20 0.37
▸ LOXL1 Q08397 1/20 0.37
▸ LOXL4 Q96JB6 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
SCHEMBL19254634 0.87 LOXL2 (0.51) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL28565642 0.86 LOXL2 (0.52) RAD52LOXL2DAOAOC3LOX
SCHEMBL19255581 0.83 RAD52 (0.42) RAD52LOXL2MEN1KMT2ALMNA
SCHEMBL20699597 0.73 LOXL2 (0.54) LOXL2DAOAOC3LOXLOXL3
SCHEMBL20699562 0.73 LOXL2 (0.55) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL19211823 0.70 LOXL2 (0.73) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL20699614 0.69 LOXL2 (0.61) LOXL2DAOAOC3LOXLOXL3
SCHEMBL19255694 0.67 LOXL2 (0.71) LOXL2DAOAOC3LOXLOXL3
Hydrochloric Acid SCHEMBL20699705 0.67 LOXL2 (0.72) LOXL2DAOAOC3LOXLOXL3
SCHEMBL20699520 0.67 LOXL2 (0.71) LOXL2DAOAOC3LOXLOXL3

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-20200317666-A1 HALOALLYLAMINE INDOLE AND AZAINDOLE DERIVATIVE INHIBITORS OF LYSYL OXIDASES AND USES THEREOF PHARMAXIS LTD. (AU) 2020-10-08 — — US disclosed
US-10717733-B2 Haloallylamine indole and azaindole derivative inhibitors of lysyl oxidases and uses thereof PHARMAXIS LTD. (AU) 2020-07-21 — — US disclosed
US-20190040007-A1 HALOALLYLAMINE INDOLE AND AZAINDOLE DERIVATIVE INHIBITORS OF LYSYL OXIDASES AND USES THEREOF PHARMAXIS LTD. (AU) 2019-02-07 — — 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-10717733-B2 Haloallylamine indole and azaindole derivative inhibitors of lysyl oxidases and uses thereof IDO1, IDO2, INMT RAD52 2266/4885PLA2G2A 2178/4885LOXL2 24/4885
US-20190040007-A1 HALOALLYLAMINE INDOLE AND AZAINDOLE DERIVATIVE INHIBITORS OF LYSYL OXIDASES AND USES THEREOF IDO1, IDO2, INMT RAD52 2266/4885PLA2G2A 2178/4885LOXL2 24/4885
US-20200317666-A1 HALOALLYLAMINE INDOLE AND AZAINDOLE DERIVATIVE INHIBITORS OF LYSYL OXIDASES AND USES THEREOF IDO1, IDO2, INMT RAD52 2266/4885PLA2G2A 2178/4885LOXL2 24/4885

“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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