SCHEMBL23522423

SCHEMBL23522423

CCc1c(OC)cc2c(c1O)C(=O)C1=C(C[C@](C)(O)[C@H](O)C1)C2=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 4/20 0.46
▸ SOS1 Q07889 2/20 0.39
▸ PTPN1 P18031 3/20 0.35
▸ EPHX2 P34913 2/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ THRB P10828 2/20 0.32
▸ RECQL P46063 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ PDCD1 Q15116 1/20 0.32
▸ CD274 Q9NZQ7 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ RGS12 O14924 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ BRCA1 P38398 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ HBB P68871 1/20 0.32

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
SCHEMBL23522427 0.84 SOS1 (0.39) IDO1SOS1PTPN1EPHX2MEN1
SCHEMBL23199091 0.78 SOS1 (0.43) IDO1SOS1PTPN1MEN1KMT2A
Altersolanol B SCHEMBL30514811 0.77 NFKB1 (0.52) IDO1SOS1KDM4ECYP3A4MAPT
Altersolanol B SCHEMBL23522406 0.77 NFKB1 (0.52) IDO1SOS1KDM4ECYP3A4MAPT
SCHEMBL29360532 0.77 NFKB1 (0.39) IDO1SOS1PTPN1
SCHEMBL16226369 0.70 MAPT (0.60) PTPN1MEN1THRBKMT2AKDM4E
SCHEMBL28872319 0.65 EPHX2 (0.51) IDO1EPHX2MEN1KMT2AMAPT
SCHEMBL16226732 0.65 IDO1 (0.62) IDO1PTPN1PDCD1CD274KDM4E
SCHEMBL23522456 0.65 IDO1 (0.47) IDO1KDM4EUSP2CYP3A4MAPT
SCHEMBL23522459 0.65 IDO1 (0.47) IDO1KDM4EUSP2CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210186947-A1 TOMM6-INTERACTING EXTRACTS AND COMPOUNDS FOR USE IN THE TREATMENT AND PROPHYLAXIS OF NERVOUS SYSTEM DISEASES, ATHEROSCLEROSIS, HEPATITIS B INFECTION AND HUMAN PAPILLOMA VIRUS (HPV) INFECTION ETH ZURICH (CH) 2021-06-24 — — 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 (1 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-20210186947-A1 TOMM6-INTERACTING EXTRACTS AND COMPOUNDS FOR USE IN THE TREATMENT AND PROPHYLAXIS OF NERVOUS SYSTEM DISEASES, ATHEROSCLEROSIS, HEPATITIS B INFECTION AND HUMAN PAPILLOMA VIRUS (HPV) INFECTION TOMM70, TOMM34, TIMM50 IDO1 3564/4885SOS1 4317/4885PTPN1 2166/4885

“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.

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