SCHEMBL17554173

SCHEMBL17554173

COc1cc(NC(=O)c2cccnc2)c(C(=O)NCCN2CCOCC2)c(OC)c1OC

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.57
CYP2C9 P11712 2/20 0.52
CYP2C19 P33261 2/20 0.52
ALDH1A1 P00352 2/20 0.51
GAA P10253 1/20 0.51
BCL3 P20749 1/20 0.51
MAPT P10636 1/20 0.50
ALOX15 P16050 1/20 0.50
LMNA P02545 1/20 0.49
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
KMT2A Q03164 1/20 0.49
HSD17B10 Q99714 1/20 0.49

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
SCHEMBL17554157 0.91 ALDH1A1 (0.52) SMN1; SMN2CYP2C19ALDH1A1MAPTKDM4E
SCHEMBL17554049 0.84 ALDH1A1 (0.68) SMN1; SMN2CYP2C9CYP2C19ALDH1A1GAA
SCHEMBL30560579 0.83 SMN1; SMN2 (0.67) SMN1; SMN2CYP2C9ALDH1A1GAAMAPT
SCHEMBL17554081 0.83 SMN1; SMN2 (0.67) SMN1; SMN2CYP2C9ALDH1A1GAAMAPT
SCHEMBL30560649 0.83 SMN1; SMN2 (0.64) SMN1; SMN2CYP2C9ALDH1A1LMNACYP2D6
SCHEMBL17554023 0.83 SMN1; SMN2 (0.64) SMN1; SMN2CYP2C9ALDH1A1LMNACYP2D6
SCHEMBL17554053 0.80 BCL3 (0.70) ALDH1A1GAABCL3LMNAKDM4E
SCHEMBL17554115 0.80 POLB (0.69) SMN1; SMN2ALDH1A1GAABCL3
SCHEMBL30560454 0.79 KDM4E (0.62) SMN1; SMN2ALDH1A1MAPTKDM4E
SCHEMBL17554121 0.79 KDM4E (0.62) SMN1; SMN2ALDH1A1MAPTKDM4E

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 SMN1; SMN2 4161/4885CYP2C9 898/4885CYP2C19 1286/4885
US-10273218-B2 BCL-3 inhibitors BCL3, BCL2, BCL2L13 SMN1; SMN2 4241/4885CYP2C9 1015/4885CYP2C19 1536/4885
US-20170267653-A1 BCL-3 INHIBITORS BCL3, BCL2, BCL2L13 SMN1; SMN2 4241/4885CYP2C9 1015/4885CYP2C19 1536/4885

“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.