SCHEMBL17554157

SCHEMBL17554157

COc1cc(NC(=O)c2cccnc2)c(C(=O)NCCN2CCN(C)CC2)c(OC)c1OC

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
POLB P06746 1/20 0.49
TSHR P16473 1/20 0.49
MAPK1 P28482 2/20 0.48
ABCB1 P08183 1/20 0.48
ABCG2 Q9UNQ0 1/20 0.48

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
SCHEMBL17554173 0.91 SMN1; SMN2 (0.57) ALDH1A1KDM4EMAPTCYP1A2CYP2C19
SCHEMBL30560454 0.88 KDM4E (0.62) ALDH1A1KDM4EMAPTSMN1; SMN2POLB
SCHEMBL17554121 0.88 KDM4E (0.62) ALDH1A1KDM4EMAPTSMN1; SMN2POLB
SCHEMBL19348474 0.84 POLB (0.56) ALDH1A1CYP1A2CYP2C19SMN1; SMN2POLB
SCHEMBL31387147 0.81 SMN1; SMN2 (0.63) ALDH1A1CYP1A2SMN1; SMN2TSHR
SCHEMBL17554051 0.80 TP53 (0.54) ALDH1A1SMN1; SMN2POLB
SCHEMBL17554018 0.80 BCL3 (0.57) ALDH1A1KDM4ESMN1; SMN2POLB
SCHEMBL26066045 0.76 KDM4E (0.65) ALDH1A1KDM4EMAPTSMN1; SMN2POLB
SCHEMBL17554079 0.75 SMN1; SMN2 (0.55) ALDH1A1KDM4ESMN1; SMN2TSHR
SCHEMBL7167519 0.75 ABCG2 (0.66) ALDH1A1POLBABCB1ABCG2

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 2635/4885KDM4E 1765/4885MAPT 3865/4885
US-10273218-B2 BCL-3 inhibitors BCL3, BCL2, BCL2L13 ALDH1A1 2830/4885KDM4E 2116/4885MAPT 4021/4885
US-20170267653-A1 BCL-3 INHIBITORS BCL3, BCL2, BCL2L13 ALDH1A1 2830/4885KDM4E 2116/4885MAPT 4021/4885

“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.