SCHEMBL22975883

SCHEMBL22975883

COC(=O)C1(C=O)CCCc2cc(Cl)ccc21

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.43
KDM4C Q9H3R0 1/20 0.39
SOD1 P00441 1/20 0.39
SIGMAR1 Q99720 2/20 0.37
SRD5A1 P18405 9/20 0.36
SRD5A2 P31213 2/20 0.36
BACE1 P56817 1/20 0.35
CYP2C19 P33261 1/20 0.34
POLA1 P09884 1/20 0.34

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
SCHEMBL21344593 1.00 KDM1A (0.43) KDM1AKDM4CSOD1SIGMAR1SRD5A1
SCHEMBL21344129 0.86 KDM1A (0.40) KDM1AKDM4CSOD1SIGMAR1SRD5A1
SCHEMBL22975956 0.86 KDM1A (0.40) KDM1AKDM4CSOD1SIGMAR1SRD5A1
SCHEMBL22975958 0.86 KDM1A (0.40) KDM1AKDM4CSOD1SIGMAR1SRD5A1
SCHEMBL21333712 0.84 KDM1A (0.47) KDM1AKDM4CSIGMAR1SRD5A1SRD5A2
SCHEMBL22975922 0.83 KDM1A (0.38) KDM1AKDM4CSOD1SIGMAR1SRD5A1
SCHEMBL22975926 0.83 KDM1A (0.38) KDM1AKDM4CSOD1SIGMAR1SRD5A1
SCHEMBL22975923 0.83 KDM1A (0.38) KDM1AKDM4CSOD1SIGMAR1SRD5A1
SCHEMBL21332603 0.77 KDM4C (0.43) KDM1AKDM4CSOD1SIGMAR1SRD5A1
SCHEMBL21332605 0.77 KDM4C (0.43) KDM1AKDM4CSOD1SIGMAR1SRD5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3762393-B1 ALPHA-HYDROXY PHENYLACETIC ACID PHARMACOPHORE OR BIOISOSTERE MCL-1 PROTEIN ANTAGONISTS AMGEN INC (US) 2023-01-11 EP disclosed
US-11274105-B2 Alpha-hydroxy phenylacetic acid pharmacophore or bioisostere Mcl-1 protein antagonists AMGEN INC. (US) 2022-03-15 US disclosed
US-20210047344-A1 ALPHA-HYDROXY PHENYLACETIC ACID PHARMACOPHORE OR BIOISOSTERE MCL-1 PROTEIN ANTAGONISTS AMGEN INC. (US) 2021-02-18 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-20210047344-A1 ALPHA-HYDROXY PHENYLACETIC ACID PHARMACOPHORE OR BIOISOSTERE MCL-1 PROTEIN ANTAGONISTS MCL1, BCL2A1, BCLAF1 KDM1A 786/4885KDM4C 3596/4885SOD1 3240/4885
US-11274105-B2 Alpha-hydroxy phenylacetic acid pharmacophore or bioisostere Mcl-1 protein antagonists MCL1, BCL2A1, BCLAF1 KDM1A 786/4885KDM4C 3596/4885SOD1 3240/4885

“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.