SCHEMBL17554167

SCHEMBL17554167

O=C(Nc1ccccc1C(=O)NCCc1ccccc1)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.77
SMN1; SMN2 Q16637 4/20 0.77
HPGD P15428 3/20 0.77
MAPT P10636 3/20 0.71
ABCG2 Q9UNQ0 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.61
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
TAAR1 Q96RJ0 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57
TDP1 Q9NUW8 1/20 0.56
LMNA P02545 1/20 0.55
GAA P10253 1/20 0.54
THRB P10828 1/20 0.54
ALOX12 P18054 1/20 0.54

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
SCHEMBL17109793 0.89 ALDH1A1 (0.88) ALDH1A1SMN1; SMN2HPGDMAPTABCG2
SCHEMBL17554060 0.88 SMN1; SMN2 (0.75) ALDH1A1SMN1; SMN2HPGDMAPTABCG2
SCHEMBL5750887 0.83 BACE1 (0.63) ALDH1A1SMN1; SMN2HPGDMAPTNPC1
SCHEMBL4092971 0.82 KMT2A (0.71) ALDH1A1SMN1; SMN2MAPTABCG2NPC1
SCHEMBL17554025 0.82 KCNH2 (0.62) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL17554152 0.81 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2ABCG2L3MBTL1NPC1
SCHEMBL10160183 0.80 SMN1; SMN2 (0.85) ALDH1A1SMN1; SMN2HPGDL3MBTL1NPC1
SCHEMBL6967304 0.79 ALDH1A1 (0.93) ALDH1A1SMN1; SMN2HPGDL3MBTL1NPC1
SCHEMBL27723289 0.79 ALDH1A1 (0.83) ALDH1A1SMN1; SMN2HPGDMAPTL3MBTL1
SCHEMBL2271993 0.79 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2HPGDMAPTABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3628374-B1 BCL-3 INHIBITORS UNIV COLLEGE CARDIFF CONSULTANTS LTD (GB) 2023-08-30 EP disclosed
EP-3628374-B1 BCL-3 INHIBITORS UNIV COLLEGE CARDIFF CONSULTANTS LTD (GB) 2023-08-30 EP disclosed
EP-3628374-A2 BCL-3 INHIBITORS University College Cardiff Consultants Limited (GB) 2020-04-01 EP disclosed
EP-3628374-A2 BCL-3 INHIBITORS University College Cardiff Consultants Limited (GB) 2020-04-01 EP disclosed
US-20190248756-A1 BCL-3 INHIBITORS UNIV COLLEGE CARDIFF CONSULTANTS LTD (GB) 2019-08-15 US disclosed
US-20190248756-A1 BCL-3 INHIBITORS UNIV COLLEGE CARDIFF CONSULTANTS LTD (GB) 2019-08-15 US disclosed
US-10273218-B2 BCL-3 inhibitors UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2019-04-30 US disclosed
US-10273218-B2 BCL-3 inhibitors UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2019-04-30 US disclosed
US-20170267653-A1 BCL-3 INHIBITORS UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2017-09-21 US disclosed
US-20170267653-A1 BCL-3 INHIBITORS UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2017-09-21 US disclosed
EP-3174602-A2 BCL-3 INHIBITORS University College Cardiff Consultants Limited (GB) 2017-06-07 EP disclosed
WO-2016016728-A2 BCL-3 INHIBITORS UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2016-02-04 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 (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-20190248756-A1 BCL-3 INHIBITORS BCL3, BCL2, BCL2L13 ALDH1A1 2635/4885SMN1; SMN2 4161/4885HPGD 3474/4885
US-10273218-B2 BCL-3 inhibitors BCL3, BCL2, BCL2L13 ALDH1A1 2830/4885SMN1; SMN2 4241/4885HPGD 3352/4885
US-20170267653-A1 BCL-3 INHIBITORS BCL3, BCL2, BCL2L13 ALDH1A1 2830/4885SMN1; SMN2 4241/4885HPGD 3352/4885

“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.