SCHEMBL20538770

SCHEMBL20538770

O=CN(Cc1cc[c]cc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ALDH1A1 P00352 3/20 0.34
NPC1 O15118 2/20 0.34
GLA P06280 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
PAX8 Q06710 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
MAPT P10636 1/20 0.33
CNR2 P34972 1/20 0.33
LMNA P02545 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TSPO P30536 1/20 0.32
HDAC1 Q13547 1/20 0.32

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
SCHEMBL3997979 0.93 TSHR (0.39) TSHRALDH1A1NPC1GLAHTT
SCHEMBL305634 0.87 TSHR (0.50) TSHRALDH1A1NPC1GLAHTT
SCHEMBL23228023 0.82 ALDH1A1 (0.40) TSHRALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL20538859 0.77 TDP1 (0.36) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL20538848 0.77 PTPN1 (0.41) TSHRALDH1A1
SCHEMBL2091210 0.75 TSHR (0.43) TSHRALDH1A1HTTCNR2CA12
SCHEMBL2085586 0.75 CNR2 (0.47) CNR2CA12CA1CA2CA9
SCHEMBL2096018 0.75 HTR2A (0.40) TSHRALDH1A1CNR2LMNACA12
SCHEMBL2093213 0.75 CYP2C19 (0.59) TSHRALDH1A1TRPM8CNR2LMNA
SCHEMBL2094150 0.75 CNR2 (0.47) MAPTCNR2MEN1KMT2AREN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912659-B2 EBNA1 inhibitors and methods using same THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2024-02-27 US disclosed
EP-3294705-B1 EBNA1 INHIBITORS AND METHODS USING SAME WISTAR INST (US) 2021-07-21 EP disclosed
US-10981867-B2 EBNA1 inhibitors and methods using same THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2021-04-20 US disclosed
US-20200239415-A1 EBNA1 INHIBITORS AND METHODS USING SAME WISTAR INST (US) 2020-07-30 US disclosed
US-10442763-B2 EBNA1 inhibitors and methods using same THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2019-10-15 US disclosed
US-20180305312-A1 EBNA1 INHIBITORS AND METHODS USING SAME NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-10-25 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-20200239415-A1 EBNA1 INHIBITORS AND METHODS USING SAME MLLT1, EBNA1BP2, MALT1 TSHR 4040/4885ALDH1A1 3939/4885NPC1 525/4885
US-20180305312-A1 EBNA1 INHIBITORS AND METHODS USING SAME MLLT1, EBNA1BP2, MALT1 TSHR 4040/4885ALDH1A1 3939/4885NPC1 525/4885
US-10981867-B2 EBNA1 inhibitors and methods using same MLLT1, EBNA1BP2, MALT1 TSHR 4040/4885ALDH1A1 3939/4885NPC1 525/4885
US-11912659-B2 EBNA1 inhibitors and methods using same MLLT1, EBNA1BP2, MALT1 TSHR 4040/4885ALDH1A1 3939/4885NPC1 525/4885
US-10442763-B2 EBNA1 inhibitors and methods using same MLLT1, EBNA1BP2, MALT1 TSHR 4040/4885ALDH1A1 3939/4885NPC1 525/4885

“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.