SCHEMBL16701449

SCHEMBL16701449

CN1CCC(Oc2ccc(-c3ccc(NC(=O)c4cc(Cl)cc(Cl)c4)cc3)cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 9/20 0.52
GSK3B P49841 8/20 0.52
KDR P35968 2/20 0.51
LCK P06239 1/20 0.51
MAPK14 Q16539 1/20 0.51
CLK2 P49760 3/20 0.51
CLK3 P49761 3/20 0.51
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
WNT1 P04628 1/20 0.48
KDM1A O60341 1/20 0.47
RCOR1 Q9UKL0 1/20 0.47
CSF1R P07333 1/20 0.45

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
SCHEMBL16701381 0.91 DYRK1A (0.47) DYRK1AGSK3BKDRLCKMAPK14
SCHEMBL16701711 0.90 KDR (0.53) DYRK1AGSK3BKDRLCKMAPK14
SCHEMBL16701405 0.90 RAB9A (0.62) DYRK1AGSK3BKDRLCKMAPK14
SCHEMBL16701630 0.87 UTS2R (0.55) DYRK1AGSK3BKDRLCKMAPK14
SCHEMBL16702050 0.86 KDR (0.60) DYRK1AGSK3BKDRLCKMAPK14
SCHEMBL18084798 0.85 SMN1; SMN2 (0.46) DYRK1AGSK3BKDRLCKMAPK14
SCHEMBL16701938 0.85 KDR (0.57) DYRK1AGSK3BKDRLCKMAPK14
SCHEMBL16701461 0.85 NPC1 (0.55) DYRK1AGSK3BKDRLCKMAPK14
SCHEMBL16701940 0.84 RAB9A (0.62) DYRK1AGSK3BKDRLCKMAPK14
SCHEMBL16702122 0.84 SCN1A (0.57) DYRK1AGSK3BKDRLCKMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3066072-B1 BIPHENYLAMIDE DERIVATIVE HSP90 INHIBITORS UNIV KANSAS (US) 2021-11-03 EP disclosed
EP-3066072-B1 BIPHENYLAMIDE DERIVATIVE HSP90 INHIBITORS UNIV KANSAS (US) 2021-11-03 EP disclosed
US-10689344-B2 Biphenylamide derivative Hsp90 inhibitors UNIVERSITY OF KANSAS (US) 2020-06-23 US disclosed
US-10689344-B2 Biphenylamide derivative Hsp90 inhibitors UNIVERSITY OF KANSAS (US) 2020-06-23 US disclosed
US-20160272584-A1 BIPHENYLAMIDE DERIVATIVE HSP90 INHIBITORS UNIVERSITY OF KANSAS (US) 2016-09-22 US disclosed
EP-3066072-A1 BIPHENYLAMIDE DERIVATIVE HSP90 INHIBITORS The University of Kansas (US) 2016-09-14 EP disclosed
WO-2015070091-A1 BIPHENYLAMIDE DERIVATIVE HSP90 INHIBITORS THE UNIVERSITY OF KANSAS (US) 2015-05-14 WO disclosed
WO-2015070091-A1 BIPHENYLAMIDE DERIVATIVE HSP90 INHIBITORS THE UNIVERSITY OF KANSAS (US) 2015-05-14 WO disclosed
US-8692018-B2 Application of iridium complexes in asymmetric catalytic hydrogenation of unsaturated carboxylic acids Zheijiang Jiuzhou Pharmaceutical Co., Ltd. (CN) 2014-04-08 US 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 (2 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-10689344-B2 Biphenylamide derivative Hsp90 inhibitors HSP90AB1, HSP90AA1, HSP90AB2P DYRK1A 2385/4885GSK3B 1960/4885KDR 3589/4885
US-20160272584-A1 BIPHENYLAMIDE DERIVATIVE HSP90 INHIBITORS HSP90AB1, HSP90AA1, HSP90AB2P DYRK1A 2385/4885GSK3B 1960/4885KDR 3589/4885

“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.