SCHEMBL8975189

SCHEMBL8975189

CC(=O)Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 2/20 0.54
▸ MTNR1B P49286 2/20 0.54
▸ FFAR4 Q5NUL3 1/20 0.52
▸ MAPT P10636 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ THRB P10828 1/20 0.52
▸ FOLH1 Q04609 1/20 0.51
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ HPGD P15428 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ APP P05067 1/20 0.51
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ RXRA P19793 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ PKM P14618 1/20 0.50
▸ SLC2A1 P11166 1/20 0.50

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
SCHEMBL10730593 0.93 SMPD1 (0.60) MTNR1AMTNR1BNPC1RAB9ASMN1; SMN2
SCHEMBL10731769 0.93 MTNR1A (0.64) MTNR1AMTNR1BNPC1RAB9ASMN1; SMN2
SCHEMBL24505350 0.88 FFAR4 (0.68) FFAR4MAPTFOLH1SMN1; SMN2RXRA
SCHEMBL3817639 0.87 FFAR4 (0.55) MTNR1AMTNR1BFFAR4MAPTPOLB
SCHEMBL5273788 0.87 SMN1; SMN2 (0.52) FFAR4MAPTTHRBFOLH1RAB9A
SCHEMBL10980236 0.87 NPC1 (0.57) FFAR4MAPTFOLH1NPC1RAB9A
SCHEMBL26851429 0.85 MTNR1A (0.55) MTNR1AMTNR1BFFAR4MAPTPOLB
SCHEMBL11827307 0.85 FFAR4 (0.64) MTNR1AMTNR1BFFAR4MAPTPOLB
SCHEMBL6214774 0.84 FOLH1 (0.51) MTNR1AMTNR1BFFAR4MAPTPOLB
SCHEMBL8072945 0.84 PTGER1 (0.52) MTNR1AMTNR1BFFAR4MAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240217945-A1 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND THEIR USE ARCADIA MEDICINE, INC. 2024-07-04 — — US disclosed
US-20240217945-A1 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND THEIR USE ARCADIA MEDICINE, INC. 2024-07-04 — — US disclosed
EP-4392402-A1 SYNTHESIS ROUTES TO ACCESS MDMA PRODRUGS BY USING CONTROLLED AND NON-CONTROLLED INTERMEDIATES Mind Medicine, Inc. (US) 2024-07-03 — — EP disclosed
US-20240115710-A1 SYNTHESIS ROUTES TO ACCESS MDMA PRODRUGS BY USING CONTROLLED AND NON-CONTROLLED INTERMEDIATES Mind Medicine, Inc. (US) 2024-04-11 — — US disclosed
US-11896670-B2 Synthesis routes to access MDMA prodrugs by using controlled and non-controlled intermediates Mind Medicine, Inc. (US) 2024-02-13 — — US disclosed
US-20230382885-A1 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND THEIR USE ARCADIA MEDICINE, INC. 2023-11-30 — — US disclosed
US-20230382885-A1 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND THEIR USE ARCADIA MEDICINE, INC. 2023-11-30 — — US disclosed
US-20230227420-A1 PRODRUGS OF MDMA, MDA, AND DERIVATIVES THEREOF EMPATHBIO, INC. 2023-07-20 — — US disclosed
US-20230227420-A1 PRODRUGS OF MDMA, MDA, AND DERIVATIVES THEREOF EMPATHBIO, INC. 2023-07-20 — — US disclosed
WO-2023056102-A1 NOVEL PRODRUGS OF MDMA, MDA, AND DERIVATIVES THEREOF ATAI Life Sciences AG (DE) 2023-04-06 — — WO disclosed
US-20230066171-A1 SYNTHESIS ROUTES TO ACCESS MDMA PRODRUGS BY USING CONTROLLED AND NON-CONTROLLED INTERMEDIATES Mind Medicine, Inc. (US) 2023-03-02 — — US disclosed
WO-2023028022-A1 SYNTHESIS ROUTES TO ACCESS MDMA PRODRUGS BY USING CONTROLLED AND NON-CONTROLLED INTERMEDIATES Mind Medicine, Inc. (US) 2023-03-02 — — WO disclosed
US-5482971-A Beta3 -adrenergic agents and their use in pharmaceutical compositions AMERICAN CYANAMID COMPANY (US) 1996-01-09 — — 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 (3 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-20230227420-A1 PRODRUGS OF MDMA, MDA, AND DERIVATIVES THEREOF COMT, PNMT, ABCB1 MTNR1A 311/4885MTNR1B 260/4885FFAR4 1004/4885
US-20240217945-A1 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND THEIR USE HTR1A, PNMT, HTR2C MTNR1A 357/4885MTNR1B 527/4885FFAR4 2397/4885
US-20230382885-A1 ENANTIOMERIC ENTACTOGEN COMPOSITIONS AND THEIR USE HTR1A, PNMT, HTR2C MTNR1A 357/4885MTNR1B 527/4885FFAR4 2397/4885

“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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