SCHEMBL17554155

SCHEMBL17554155

COc1cccc(C(=O)Nc2cccc(F)c2C(=O)NCCN2CCNCC2)c1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
DRD4 P21917 13/20 0.57
RAB9A P51151 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
DRD2 P14416 4/20 0.53
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
MAPT P10636 1/20 0.52
PMP22 Q01453 1/20 0.52
CHRM3 P20309 1/20 0.51
HTR4 Q13639 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL17554012 0.91 BCL3 (0.60) CYP2C9CYP2C19DRD4CYP1A2CYP3A4
SCHEMBL17554107 0.91 DRD4 (0.61) CYP2C9CYP2C19DRD4RAB9ASMN1; SMN2
SCHEMBL17554111 0.81 ALDH1A1 (0.60) CYP2C9CYP2C19DRD4DRD2CYP1A2
SCHEMBL17554082 0.79 BCL3 (0.74) CYP2C9CYP2C19CYP1A2CYP3A4CYP2D6
SCHEMBL17554097 0.79 ALDH1A1 (0.65) CYP2C9CYP2C19DRD4DRD2CYP1A2
SCHEMBL30560578 0.79 ALDH1A1 (0.65) CYP2C9CYP2C19DRD4DRD2CYP1A2
SCHEMBL17554158 0.79 BCL3 (0.62) CYP2C9CYP2C19DRD4RAB9ADRD2
SCHEMBL30560605 0.79 BCL3 (0.62) CYP2C9CYP2C19DRD4RAB9ADRD2
SCHEMBL29849812 0.77 ALDH1A1 (0.80) CYP2C9CYP2C19DRD4SMN1; SMN2DRD2
SCHEMBL16431097 0.77 ALDH1A1 (0.80) CYP2C9CYP2C19DRD4SMN1; SMN2DRD2

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 CYP2C9 898/4885CYP2C19 1286/4885DRD4 1508/4885
US-10273218-B2 BCL-3 inhibitors BCL3, BCL2, BCL2L13 CYP2C9 1015/4885CYP2C19 1536/4885DRD4 2062/4885
US-20170267653-A1 BCL-3 INHIBITORS BCL3, BCL2, BCL2L13 CYP2C9 1015/4885CYP2C19 1536/4885DRD4 2062/4885

“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.