SCHEMBL17554138

SCHEMBL17554138

O=C(Nc1ccccc1C(=O)NCCCc1ccccc1)c1ccc2ccccc2c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 9/20 0.77
PPARG P37231 5/20 0.77
PPARA Q07869 3/20 0.60
PPARD Q03181 1/20 0.60
SLC16A3 O15427 1/20 0.57
MAPT P10636 2/20 0.56
HTT P42858 2/20 0.56
KDM4E B2RXH2 1/20 0.56
NPC1 O15118 3/20 0.54
HPGD P15428 2/20 0.54
ALDH1A1 P00352 1/20 0.54
TSHR P16473 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
HSD17B10 Q99714 1/20 0.54
NLRP1 Q9C000 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
OPRM1 P35372 1/20 0.53
TMEM97 Q5BJF2 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
RAB9A P51151 2/20 0.52

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
SCHEMBL17554117 0.83 ABCG2 (0.63) NR1H4PPARGPPARAPPARDMAPT
SCHEMBL30560465 0.83 ABCG2 (0.63) NR1H4PPARGPPARAPPARDMAPT
SCHEMBL24133347 0.82 NR1H4 (0.74) NR1H4PPARGPPARAPPARDSLC16A3
SCHEMBL30560536 0.81 NR1H4 (0.55) NR1H4PPARGMAPTHTTKDM4E
SCHEMBL17554014 0.81 NR1H4 (0.55) NR1H4PPARGMAPTHTTKDM4E
SCHEMBL17554087 0.81 PPARG (0.76) NR1H4PPARGSLC16A3MAPTHTT
SCHEMBL17554096 0.79 NR1H4 (0.67) NR1H4PPARGMAPTKDM4ENPC1
SCHEMBL21870109 0.79 NPC1 (0.51) NR1H4PPARGMAPTHTTKDM4E
SCHEMBL24133370 0.79 NR1H4 (0.66) NR1H4PPARGPPARAPPARDSLC16A3
SCHEMBL5750887 0.79 BACE1 (0.63) NR1H4PPARGPPARAMAPTHTT

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 13 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
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 NR1H4 2479/4885PPARG 3081/4885PPARA 4470/4885
US-10273218-B2 BCL-3 inhibitors BCL3, BCL2, BCL2L13 NR1H4 2842/4885PPARG 2993/4885PPARA 4433/4885
US-20170267653-A1 BCL-3 INHIBITORS BCL3, BCL2, BCL2L13 NR1H4 2842/4885PPARG 2993/4885PPARA 4433/4885

“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.