SCHEMBL21628782

SCHEMBL21628782

COC(=O)c1ccc(Oc2ccc(C)cc2)c(F)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.54
IGFBP3 P17936 1/20 0.50
USP2 O75604 1/20 0.50
MAPT P10636 4/20 0.48
MAPK1 P28482 3/20 0.48
ALDH1A1 P00352 4/20 0.47
HPGD P15428 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 3/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
MMP13 P45452 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
NOTUM Q6P988 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL21628662 0.86 KMT2A (0.48) USP2MAPTMAPK1ALDH1A1HPGD
SCHEMBL21628569 0.86 IGFBP3 (0.48) TDP1IGFBP3MAPTMAPK1ALDH1A1
SCHEMBL26563278 0.85 TDP1 (0.58) TDP1USP2MAPTMAPK1ALDH1A1
SCHEMBL21628442 0.85 MAPK1 (0.61) IGFBP3MAPTMAPK1ALDH1A1LMNA
SCHEMBL21628831 0.85 MAPT (0.55) IGFBP3USP2MAPTMAPK1ALDH1A1
SCHEMBL21628720 0.85 USP2 (0.47) USP2MAPTMAPK1ALDH1A1HPGD
SCHEMBL21628412 0.85 ALDH1A1 (0.66) TDP1USP2MAPTMAPK1ALDH1A1
SCHEMBL21628451 0.84 HDAC1 (0.56) IGFBP3MAPTMAPK1LMNAMMP13
SCHEMBL21656765 0.84 MMP13 (0.65) IGFBP3MAPTMAPK1HPGDLMNA
SCHEMBL15669422 0.84 NPC1 (0.53) USP2MAPTMAPK1ALDH1A1HPGD

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-12600696-B2 Aromatic compounds Xeniopro GmbH (DE) 2026-04-14 US disclosed
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-12-21 US disclosed
US-20230150923-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2023-05-18 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 US disclosed
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2022-11-03 US disclosed
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2021-04-15 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 US disclosed
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS Xeniopro GmbH (DE) 2020-01-30 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 (7 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-20230150923-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK TDP1 1383/4885IGFBP3 3214/4885USP2 2436/4885
US-20220348535-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK TDP1 1383/4885IGFBP3 3214/4885USP2 2436/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK TDP1 1153/4885IGFBP3 2998/4885USP2 2531/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK TDP1 1383/4885IGFBP3 3214/4885USP2 2436/4885
US-12600696-B2 Aromatic compounds CCR1, CCRL2, AHR TDP1 1012/4885IGFBP3 1912/4885USP2 2314/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK TDP1 1383/4885IGFBP3 3214/4885USP2 2436/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK TDP1 1383/4885IGFBP3 3214/4885USP2 2436/4885

“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.