SCHEMBL21812480

SCHEMBL21812480

C/C(=N\Nc1ccc(Br)cc1)c1ccncc1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.71
KDM4E B2RXH2 3/20 0.71
MEN1 O00255 4/20 0.69
KMT2A Q03164 4/20 0.69
GAA P10253 6/20 0.58
MAPT P10636 6/20 0.58
NPC1 O15118 4/20 0.58
TDP1 Q9NUW8 3/20 0.58
RAB9A P51151 3/20 0.58
POLB P06746 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
CASP6 P55212 1/20 0.58
GFER P55789 3/20 0.58
RECQL P46063 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.56
LMNA P02545 2/20 0.51

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
SCHEMBL21812481 1.00 ALDH1A1 (0.71) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL8230499 0.83 ALDH1A1 (0.71) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL10067333 0.83 ALDH1A1 (0.71) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL2061789 0.83 ALDH1A1 (0.71) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL7950232 0.81 RAB9A (0.65) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL21841789 0.80 GAA (0.52) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL21812330 0.80 GAA (0.52) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL21812329 0.80 GAA (0.52) ALDH1A1KDM4EMEN1KMT2AGAA
Hydrochloric Acid SCHEMBL1606124 0.80 RAB9A (0.64) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL24572633 0.80 ALDH1A1 (0.67) ALDH1A1KDM4EMEN1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3856736-B1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS CALLIDITAS THERAPEUTICS SUISSE SA (CH) 2026-05-06 EP disclosed
US-12202816-B2 Compounds as NADPH oxidase inhibitors CALLIDITAS THERAPEUTICS SUISSE SA (CH) 2025-01-21 US disclosed
US-20220033379-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS CALLIDITAS THERAPEUTICS SUISSE SA (CH) 2022-02-03 US disclosed
US-20220033379-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS CALLIDITAS THERAPEUTICS SUISSE SA (CH) 2022-02-03 US disclosed
EP-3856736-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS GenKyoTex Suisse SA (CH) 2021-08-04 EP disclosed
WO-2020065048-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS GENKYOTEX SUISSE SA (CH) 2020-04-02 WO disclosed
EP-3628669-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS GenKyoTex Suisse SA (CH) 2020-04-01 EP disclosed
EP-3628669-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS GenKyoTex Suisse SA (CH) 2020-04-01 EP 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-12202816-B2 Compounds as NADPH oxidase inhibitors CYBB, NOX1, NOX4 ALDH1A1 285/4885KDM4E 3830/4885MEN1 4789/4885
US-20220033379-A1 NOVEL COMPOUNDS AS NADPH OXIDASE INHIBITORS CYBB, NOX1, NOX4 ALDH1A1 309/4885KDM4E 3748/4885MEN1 4840/4885

“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.