SCHEMBL14487296

SCHEMBL14487296

COC(=O)Cc1c[nH]c2ccc(CNC(=O)OC(C)(C)C)cc12

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
MTNR1A P48039 3/20 0.45
MTNR1B P49286 2/20 0.45
TACR1 P25103 3/20 0.44
KDM4E B2RXH2 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
TRPV1 Q8NER1 1/20 0.43
CTSL P07711 2/20 0.42
HTT P42858 1/20 0.42
PKM P14618 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GPR84 Q9NQS5 1/20 0.41

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
SCHEMBL14487506 0.91 KMT2A (0.49) KMT2AMTNR1AMTNR1BTACR1L3MBTL1
SCHEMBL14487904 0.90 KDM4E (0.53) KMT2AMTNR1AMTNR1BTACR1KDM4E
SCHEMBL30937472 0.83 CTSL (0.50) KMT2AMTNR1AMTNR1BTACR1L3MBTL1
SCHEMBL5346685 0.83 KMT2A (0.48) KMT2AMTNR1AMTNR1BTACR1KDM4E
SCHEMBL29993523 0.82 L3MBTL1 (0.47) KMT2ATACR1L3MBTL1CTSLCTSS
SCHEMBL15730129 0.82 L3MBTL1 (0.47) KMT2ATACR1L3MBTL1CTSLCTSS
SCHEMBL14487538 0.82 MTNR1A (0.55) MTNR1AMTNR1BTACR1KDM4ECTSL
SCHEMBL7220655 0.81 CHRNA7 (0.48) KMT2ATACR1L3MBTL1MEN1MAPT
SCHEMBL29792607 0.81 CHRNA7 (0.48) KMT2ATACR1L3MBTL1MEN1MAPT
SCHEMBL14487340 0.81 KMT2A (0.47) KMT2ATACR1KDM4EL3MBTL1CTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2023-01-12 US disclosed
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2023-01-12 US disclosed
US-11034668-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2021-06-15 US disclosed
US-11034668-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2021-06-15 US disclosed
US-10370358-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2019-08-06 US disclosed
US-20180194746-A1 Compounds For the Treatment of HIV GILEAD SCIENCES, INC. 2018-07-12 US disclosed
US-9944619-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2018-04-17 US disclosed
US-9944619-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2018-04-17 US disclosed
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2017-05-18 US disclosed
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2017-05-18 US disclosed
US-9540343-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2017-01-10 US disclosed
US-9540343-B2 Compounds for the treatment of HIV GILEAD SCIENCES, INC. (US) 2017-01-10 US disclosed
EP-2729448-B1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES INC (US) 2015-09-09 EP disclosed
EP-2729448-B1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES INC (US) 2015-09-09 EP disclosed
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2014-05-22 US disclosed
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2014-05-22 US disclosed
EP-2729448-A1 COMPOUNDS FOR THE TREATMENT OF HIV Gilead Sciences, Inc. (US) 2014-05-14 EP disclosed
WO-2013006738-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2013-01-10 WO disclosed
WO-2013006738-A1 COMPOUNDS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. (US) 2013-01-10 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-10370358-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN KMT2A 2804/4885MTNR1A 4595/4885MTNR1B 4364/4885
US-20180194746-A1 Compounds For the Treatment of HIV CCR5, NPC1, FURIN KMT2A 2804/4885MTNR1A 4595/4885MTNR1B 4364/4885
US-11034668-B2 Compounds for the treatment of HIV CCR5, NPC1, FURIN KMT2A 2804/4885MTNR1A 4595/4885MTNR1B 4364/4885
US-20170137405-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN KMT2A 2804/4885MTNR1A 4595/4885MTNR1B 4364/4885
US-20140142085-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN KMT2A 2804/4885MTNR1A 4595/4885MTNR1B 4364/4885
US-20230012449-A1 COMPOUNDS FOR THE TREATMENT OF HIV CCR5, NPC1, FURIN KMT2A 2804/4885MTNR1A 4595/4885MTNR1B 4364/4885

“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.