SCHEMBL21656483

SCHEMBL21656483

C=CCC(CC)(CC)c1ccc(Oc2ccc(C(=O)OC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.44
▸ LMNA P02545 2/20 0.44
▸ CA1 P00915 3/20 0.44
▸ CA2 P00918 3/20 0.44
▸ PKM P14618 1/20 0.42
▸ RAB9A P51151 4/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ HPGD P15428 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ NPC1 O15118 3/20 0.39
▸ TP53 P04637 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ STS P08842 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL21656587 0.87 HPGD (0.58) MAPTLMNAPKMRAB9ASMN1; SMN2
SCHEMBL21656579 0.87 CA1 (0.45) MAPTCA1CA2PKMRAB9A
SCHEMBL21656977 0.86 LMNA (0.57) MAPTLMNAMAPK1ALDH1A1
SCHEMBL23228713 0.86 LMNA (0.43) MAPTLMNACA1CA2PKM
SCHEMBL23228769 0.85 PARP10 (0.51) CA1CA2RAB9ASMN1; SMN2HPGD
SCHEMBL23228792 0.85 ALDH1A1 (0.44) MAPTLMNAHPGDMAPK1KMT2A
SCHEMBL2656679 0.83 MAPT (0.49) MAPTCA1CA2PKMRAB9A
SCHEMBL23228794 0.83 HPGD (0.56) PKMRAB9ASMN1; SMN2HPGDTSHR
SCHEMBL21656881 0.80 LMNA (0.40) MAPTLMNASMN1; SMN2HPGDKMT2A
SCHEMBL21166650 0.77 MAPT (0.57) MAPTPKMRAB9ASMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11591289-B2 Aromatic compounds Xeniopro GmbH (DE) 2023-02-28 — — 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 (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-11591289-B2 Aromatic compounds AHR, TYR, MUSK MAPT 2195/4885LMNA 3083/4885CA1 4882/4885
US-20200031763-A1 NOVEL AROMATIC COMPOUNDS AHR, TYR, MUSK MAPT 2272/4885LMNA 3327/4885CA1 4881/4885

“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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