SCHEMBL18125083

SCHEMBL18125083

CCCC(C)C(=O)NCC(C)(C)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 2/20 0.41
HPGD P15428 1/20 0.38
HSD17B10 Q99714 2/20 0.38
POLB P06746 1/20 0.38
CNR1 P21554 2/20 0.36
CNR2 P34972 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
PIK3CD O00329 1/20 0.36
FPR2 P25090 1/20 0.36

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
SCHEMBL18125095 1.00 MAPK1 (0.45) MAPK1LMNAMAPTTSHRHPGD
SCHEMBL18125097 1.00 MAPK1 (0.45) MAPK1LMNAMAPTTSHRHPGD
SCHEMBL20353957 0.86 CA1 (0.46) CNR1CNR2CA1CA2
SCHEMBL12975647 0.84 PIK3CD (0.38) TSHRHSD17B10CNR1CNR2PIK3CD
SCHEMBL18124674 0.81 CA1 (0.42) CNR1CNR2HDAC7HDAC8HDAC6
SCHEMBL18124669 0.81 CA1 (0.42) CNR1CNR2HDAC7HDAC8HDAC6
SCHEMBL18124638 0.81 CA1 (0.42) CNR1CNR2HDAC7HDAC8HDAC6
SCHEMBL18923186 0.79 CA2 (0.47) MAPK1TSHRCNR1CNR2HDAC7
SCHEMBL18664268 0.79 CA2 (0.47) MAPK1TSHRCNR1CNR2HDAC7
SCHEMBL4151782 0.77 MAPK1 (0.51) MAPK1LMNAMAPTTSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220218709-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. 2022-07-14 US disclosed
US-10285990-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2019-05-14 US disclosed
EP-3321265-A1 4,6-DIAMINO-PYRIDO[3,2-D]PYRIMIDINE COMPOUNDS AND THEIR UTILISATION AS MODULATORS OF TOLL-LIKE RECEPTORS Gilead Sciences, Inc. (US) 2018-05-16 EP disclosed
US-20170281627-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. 2017-10-05 US disclosed
US-9670205-B2 Toll like receptor modulator compounds GILEAD SCIENCES, INC. (US) 2017-06-06 US disclosed
US-20170071944-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2017-03-16 US disclosed
US-20160289229-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS GILEAD SCIENCES, INC. 2016-10-06 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-20170281627-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS TLR8, TLR3, TLR6 MAPK1 1174/4885LMNA 3552/4885MAPT 3676/4885
US-10285990-B2 Toll like receptor modulator compounds TLR8, TLR3, TLR6 MAPK1 1174/4885LMNA 3552/4885MAPT 3676/4885
US-20220218709-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS TLR8, TLR3, TLR6 MAPK1 1174/4885LMNA 3552/4885MAPT 3676/4885
US-20160289229-A1 TOLL LIKE RECEPTOR MODULATOR COMPOUNDS TLR8, TLR3, TLR6 MAPK1 1174/4885LMNA 3552/4885MAPT 3676/4885
US-20170071944-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV TLR8, TLR3, TLR6 MAPK1 1985/4885LMNA 4121/4885MAPT 2669/4885

“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.