SCHEMBL20898337

SCHEMBL20898337

CC1(C)C[C@H]2CN(c3ccc(N4CCS(=O)(=O)CC4)cc3)[C@@H]1CNC2=O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KDM5B Q9UGL1 1/20 0.32
TGFBR1 P36897 1/20 0.31
ACVR1 Q04771 1/20 0.31
ALK Q9UM73 1/20 0.31
QPCT Q16769 1/20 0.30
FAAH O00519 5/20 0.30
BRD4 O60885 1/20 0.30

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
SCHEMBL22567417 1.00 KDM4E (0.36) KDM4EALDH1A1KDM5BTGFBR1ACVR1
SCHEMBL22567430 1.00 KDM4E (0.36) KDM4EALDH1A1KDM5BTGFBR1ACVR1
SCHEMBL22567318 1.00 KDM4E (0.36) KDM4EALDH1A1KDM5BTGFBR1ACVR1
SCHEMBL22555819 1.00 KDM4E (0.36) KDM4EALDH1A1KDM5BTGFBR1ACVR1
SCHEMBL20898255 0.86 PDE3B (0.38) KDM4EALDH1A1
SCHEMBL22567453 0.84 IDH1 (0.31)
SCHEMBL20907313 0.84 IDH1 (0.31)
SCHEMBL20898281 0.84 IDH1 (0.31)
SCHEMBL22567341 0.82 KDM4E (0.39) KDM4EALDH1A1KDM5BTGFBR1ACVR1
SCHEMBL22567340 0.82 KDM4E (0.39) KDM4EALDH1A1KDM5BTGFBR1ACVR1

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
US-12060360-B2 Lysyl oxidase inhibitors THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2024-08-13 US disclosed
US-20220289757-A1 LYSYL OXIDASE INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2022-09-15 US disclosed
US-11325915-B2 Lysyl oxidase inhibitors THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2022-05-10 US disclosed
US-11325915-B2 Lysyl oxidase inhibitors THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2022-05-10 US disclosed
US-20200331922-A1 LYSYL OXIDASE INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2020-10-22 US disclosed
US-20200331922-A1 LYSYL OXIDASE INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2020-10-22 US disclosed
EP-3694857-A1 LYSYL OXIDASE INHIBITORS The Institute of Cancer Research: Royal Cancer Hospital (GB) 2020-08-19 EP disclosed
WO-2019073251-A1 LYSYL OXIDASE INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2019-04-18 WO disclosed
WO-2019073251-A1 LYSYL OXIDASE INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2019-04-18 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 (4 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-20200331922-A1 LYSYL OXIDASE INHIBITORS LOXL1, LOXL2, LOXL3 KDM4E 974/4885ALDH1A1 1199/4885KDM5B 598/4885
US-12060360-B2 Lysyl oxidase inhibitors LOXL1, LOXL2, LOXL3 KDM4E 974/4885ALDH1A1 1199/4885KDM5B 598/4885
US-20220289757-A1 LYSYL OXIDASE INHIBITORS LOXL1, LOXL2, LOXL3 KDM4E 974/4885ALDH1A1 1199/4885KDM5B 598/4885
US-11325915-B2 Lysyl oxidase inhibitors LOXL1, LOXL2, LOXL3 KDM4E 974/4885ALDH1A1 1199/4885KDM5B 598/4885

“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.