SCHEMBL21628558

SCHEMBL21628558

COC(=O)c1ccc(Oc2ccc(C3C4CC5CC(C4)CC3C5)cc2)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.43
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
OPRM1 P35372 5/20 0.38
OPRK1 P41145 5/20 0.38
MET P08581 1/20 0.38
AXL P30530 1/20 0.38
OPRD1 P41143 3/20 0.38
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
KCNQ3 O43525 1/20 0.37
KCNQ2 O43526 1/20 0.37
KCNE1 P15382 1/20 0.37
KCNQ1 P51787 1/20 0.37
EPHX2 P34913 1/20 0.36
STS P08842 1/20 0.36

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
SCHEMBL21628560 1.00 USP2 (0.43) USP2KMT2AALDH1A1HPGDNPSR1
SCHEMBL21628841 0.88 OPRM1 (0.40) OPRM1OPRK1OPRD1LMNAMAPT
SCHEMBL21628843 0.88 OPRM1 (0.40) OPRM1OPRK1OPRD1LMNAMAPT
SCHEMBL21656931 0.88 HPGD (0.43) HPGDOPRM1OPRK1METAXL
SCHEMBL21628861 0.87 LMNA (0.46) OPRM1OPRK1OPRD1LMNAMAPK1
SCHEMBL21628862 0.87 LMNA (0.46) OPRM1OPRK1OPRD1LMNAMAPK1
SCHEMBL21656895 0.86 OPRM1 (0.48) OPRM1OPRK1OPRD1KCNQ3KCNQ2
SCHEMBL21628771 0.86 PARP10 (0.48) KMT2AALDH1A1OPRM1OPRK1OPRD1
SCHEMBL21628772 0.86 PARP10 (0.48) KMT2AALDH1A1OPRM1OPRK1OPRD1
SCHEMBL21656936 0.85 GPR119 (0.44) ALDH1A1HPGDOPRM1OPRK1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 (5 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 USP2 2436/4885KMT2A 313/4885ALDH1A1 717/4885
US-11591289-B2 Aromatic compounds AHR, TYR, MUSK USP2 2531/4885KMT2A 248/4885ALDH1A1 900/4885
US-20210107863-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK USP2 2436/4885KMT2A 313/4885ALDH1A1 717/4885
US-20230406814-A2 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK USP2 2436/4885KMT2A 313/4885ALDH1A1 717/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK USP2 2436/4885KMT2A 313/4885ALDH1A1 717/4885

“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.