SCHEMBL16731645

SCHEMBL16731645

O=C(O)c1cccc(C#Cc2nccs2)c1F

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.48
▸ CYP1A2 P05177 1/20 0.44
▸ HAO1 Q9UJM8 2/20 0.41
▸ NAPRT Q6XQN6 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ ASPH Q12797 1/20 0.39
▸ KDM8 Q8N371 1/20 0.39
▸ MRGPRX4 Q96LA9 1/20 0.38
▸ PTPN2 P17706 1/20 0.37
▸ PTPRB P23467 1/20 0.37
▸ PTPN6 P29350 1/20 0.37
▸ ACACB O00763 1/20 0.37
▸ PDE10A Q9Y233 1/20 0.36
▸ VCP P55072 1/20 0.36
▸ PTGES O14684 1/20 0.36
▸ DHODH Q02127 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ HPGD P15428 1/20 0.35

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
SCHEMBL16731649 0.80 GRM5 (0.43) GRM5CYP1A2HAO1KDM4EACACB
SCHEMBL18125281 0.76 CTSA (0.43) GRM5CYP1A2HAO1KDM4EALDH1A1
SCHEMBL16731647 0.74 DHODH (0.48) HAO1DHODHALDH1A1PKMHPGD
SCHEMBL6311838 0.73 GRM5 (0.59) GRM5CYP1A2KDM4EACACBPDE10A
SCHEMBL16719929 0.73 NPC1 (0.57) CYP1A2NAPRTKDM4EALDH1A1HPGD
SCHEMBL16720356 0.73 GRM5 (0.48) GRM5NAPRTKDM4EASPHKDM8
SCHEMBL16731663 0.73 NPC1 (0.40) GRM5HAO1ALDH1A1PKM
SCHEMBL16731648 0.73 HSD11B1 (0.39) GRM5CYP1A2HAO1KDM4EPDE10A
SCHEMBL16731670 0.73 GRM5 (0.40) GRM5CYP1A2HAO1HPGD
SCHEMBL16719567 0.72 LRRK2 (0.48) NAPRTKDM4EDHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220396551-A1 EBNA1 Inhibitors and Their Method of Use WISTAR INST (US) 2022-12-15 — — US disclosed
US-11242317-B2 EBNA1 inhibitors and their method of use THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2022-02-08 — — US disclosed
EP-3068758-B1 EBNA1 INHIBITORS AND THEIR METHOD OF USE WISTAR INST (US) 2021-09-08 — — EP disclosed
US-20200181078-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE WISTAR INST (US) 2020-06-11 — — US disclosed
US-10421718-B2 EBNA1 inhibitors and their method of use THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2019-09-24 — — US disclosed
US-20180086699-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-03-29 — — US disclosed
US-20180086699-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-03-29 — — US disclosed
US-9856214-B2 EBNA1 inhibitors and their method of use THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2018-01-02 — — US disclosed
US-20160289185-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-10-06 — — US disclosed
US-20160289185-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-10-06 — — US disclosed
WO-2015073864-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2015-05-21 — — WO 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 (6 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-11242317-B2 EBNA1 inhibitors and their method of use EBNA1BP2, MLLT1, PML GRM5 3225/4885CYP1A2 3915/4885HAO1 3967/4885
US-20160289185-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE MCM5, EBNA1BP2, MLLT1 GRM5 3154/4885CYP1A2 3914/4885HAO1 4027/4885
US-20200181078-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE EBNA1BP2, MLLT1, PML GRM5 3225/4885CYP1A2 3915/4885HAO1 3967/4885
US-10421718-B2 EBNA1 inhibitors and their method of use EBNA1BP2, MLLT1, PML GRM5 3225/4885CYP1A2 3915/4885HAO1 3967/4885
US-20180086699-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE EBNA1BP2, MLLT1, PML GRM5 3225/4885CYP1A2 3915/4885HAO1 3967/4885
US-20220396551-A1 EBNA1 Inhibitors and Their Method of Use EBNA1BP2, MLLT1, PML GRM5 3225/4885CYP1A2 3915/4885HAO1 3967/4885

“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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