SCHEMBL8938387

SCHEMBL8938387

O=C(O)c1[nH]c2ccc(Cl)cc2c1Cc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NHERF1 O14745 1/20 0.66
ALDH1A1 P00352 3/20 0.66
MAPT P10636 2/20 0.66
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
SIRT2 Q8IXJ6 1/20 0.65
SIRT1 Q96EB6 1/20 0.65
MAP2 P11137 1/20 0.60
POLB P06746 4/20 0.59
PKM P14618 1/20 0.57
CNR1 P21554 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
GPR17 Q13304 1/20 0.51

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
SCHEMBL8938451 0.84 ALDH1A1 (0.68) NHERF1ALDH1A1MAPTMEN1KMT2A
SCHEMBL3091494 0.83 KDM4E (0.66) NHERF1ALDH1A1MAPTMEN1KMT2A
SCHEMBL6756295 0.82 KDM4E (0.65) ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL9449420 0.81 KDM4E (0.71) ALDH1A1MAPTMEN1KMT2AMAP2
SCHEMBL2538695 0.81 PRNP (0.69) ALDH1A1MAPTMEN1KMT2ASIRT1
SCHEMBL16516496 0.79 POLB (0.60) ALDH1A1MAPTMEN1KMT2AMAP2
SCHEMBL4615348 0.79 SIRT1 (0.62) ALDH1A1MAPTMEN1KMT2ASIRT1
SCHEMBL9190459 0.79 GPR17 (0.80) ALDH1A1MAP2POLBKDM4EGPR17
SCHEMBL27644764 0.78 MEN1 (0.59) NHERF1ALDH1A1MAPTMEN1KMT2A
SCHEMBL23511153 0.78 ALDH1A1 (0.66) NHERF1ALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10577356-B2 Beta-arrestin-biased cannabinoid CB1 receptor agonists and methods for making and using them THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2020-03-03 US disclosed
US-10577356-B2 Beta-arrestin-biased cannabinoid CB1 receptor agonists and methods for making and using them THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2020-03-03 US disclosed
US-20190040045-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2019-02-07 US disclosed
US-20190040045-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2019-02-07 US disclosed
US-10118914-B2 Beta-arrestin-biased cannabinoid CB1 receptor agonists and methods for making and using them THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2018-11-06 US disclosed
US-20170166554-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2017-06-15 US disclosed
US-20170166554-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2017-06-15 US disclosed
US-20170166554-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2017-06-15 US disclosed
WO-2015195486-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM THE UNIVERSITY OF NORTH CAROLINA AT GREENSBORO (US) 2015-12-23 WO disclosed
US-5527819-A TREATING AIDS MERCK & CO., INC. (US) 1996-06-18 US disclosed
CN-1119856-A Hiv reverse transcriptase inhibitors MERCK & CO INC (US) 1996-04-03 CN disclosed
EP-0686148-A4 INHIBITORS OF HIV REVERSE TRANSCRIPTASE MERCK & CO INC (US) 1996-02-07 EP disclosed
EP-0686148-A1 INHIBITORS OF HIV REVERSE TRANSCRIPTASE MERCK & CO. INC. (US) 1995-12-13 EP disclosed
EP-0678508-A1 Indoles as inhibitors of HIV reverse transcriptase MERCK & CO. INC. (US) 1995-10-25 EP disclosed
WO-1994019321-A1 INHIBITORS OF HIV REVERSE TRANSCRIPTASE MERCK & CO., INC. (US) 1994-09-01 WO disclosed
WO-1993005020-A1 INDOLES AS INHIBITORS OF HIV REVERSE TRANSCRIPTASE MERCK & CO., INC. (US) 1993-03-18 WO disclosed
EP-0530907-A1 Indoles as inhibitors of HIV reverse transcriptase MERCK & CO. INC. (US) 1993-03-10 EP 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 (4 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-20170166554-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM CNR1, CNR2, ARRB1 NHERF1 2236/4885ALDH1A1 2372/4885MAPT 3519/4885
US-10577356-B2 Beta-arrestin-biased cannabinoid CB1 receptor agonists and methods for making and using them CNR1, CNR2, ARRB1 NHERF1 2236/4885ALDH1A1 2372/4885MAPT 3519/4885
US-10118914-B2 Beta-arrestin-biased cannabinoid CB1 receptor agonists and methods for making and using them CNR1, CNR2, ARRB1 NHERF1 2236/4885ALDH1A1 2372/4885MAPT 3519/4885
US-20190040045-A1 BETA-ARRESTIN-BIASED CANNABINOID CB1 RECEPTOR AGONISTS AND METHODS FOR MAKING AND USING THEM CNR1, CNR2, ARRB1 NHERF1 2236/4885ALDH1A1 2372/4885MAPT 3519/4885

“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.