SCHEMBL16427745

SCHEMBL16427745

CCOC(=O)c1ccnn1CC(=O)c1ccc(OC)c(OC)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 2/20 0.50
▸ MAPT P10636 6/20 0.49
▸ TSHR P16473 1/20 0.49
▸ KMT2A Q03164 3/20 0.47
▸ HTT P42858 1/20 0.47
▸ LMNA P02545 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ HSD17B2 P37059 1/20 0.46
▸ CTNNB1 P35222 1/20 0.46
▸ WNT3A P56704 1/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ PPARG P37231 1/20 0.46
▸ NCOA2 Q15596 1/20 0.46
▸ NCOA1 Q15788 1/20 0.46
▸ NCOA3 Q9Y6Q9 1/20 0.46
▸ MEN1 O00255 2/20 0.46

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
SCHEMBL19498643 0.85 CA12 (0.51) PDE4BMAPTTSHRKMT2AALDH1A1
SCHEMBL16427759 0.84 PDE4B (0.50) PDE4BMAPTTSHRKMT2AHTT
SCHEMBL16427211 0.82 PDE4D (0.50) PDE4BMAPTTSHRKMT2AHTT
SCHEMBL16426583 0.81 PDE4B (0.50) PDE4BMAPTTSHRKMT2AHTT
SCHEMBL16437437 0.81 PDE4B (0.51) PDE4BMAPTTSHRKMT2AALDH1A1
SCHEMBL16426964 0.80 PDE4B (0.48) PDE4BMAPTTSHRKMT2AHTT
SCHEMBL19253553 0.77 ALDH1A1 (0.41) TSHRLMNAALDH1A1POLBKDM4E
SCHEMBL22125716 0.76 KDM4E (0.41) TSHRLMNAALDH1A1POLBCYP2C19
SCHEMBL30506315 0.75 HSD17B2 (0.76) MAPTTSHRKMT2AHTTLMNA
SCHEMBL1660365 0.75 HSD17B2 (0.76) MAPTTSHRKMT2AHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10005774-B2 Syk inhibitors GILEAD SCIENCES, INC. (US) 2018-06-26 — — US disclosed
US-10005774-B2 Syk inhibitors GILEAD SCIENCES, INC. (US) 2018-06-26 — — US disclosed
EP-3027601-B1 SYK INHIBITORS GILEAD SCIENCES INC (US) 2017-10-25 — — EP disclosed
EP-3027601-B1 SYK INHIBITORS GILEAD SCIENCES INC (US) 2017-10-25 — — EP disclosed
US-20160368918-A1 SYK INHIBITORS Kronos Bio, Inc. 2016-12-22 — — US disclosed
US-20160368918-A1 SYK INHIBITORS Kronos Bio, Inc. 2016-12-22 — — US disclosed
US-9376441-B2 Substituted pyrrolidines as SYK inhibitors GILEAD SCIENCES, INC. (US) 2016-06-28 — — US disclosed
US-9376441-B2 Substituted pyrrolidines as SYK inhibitors GILEAD SCIENCES, INC. (US) 2016-06-28 — — US disclosed
EP-3027601-A1 SYK INHIBITORS Gilead Sciences, Inc. (US) 2016-06-08 — — EP disclosed
US-20150038488-A1 SYK INHIBITORS Kronos Bio, Inc. 2015-02-05 — — US disclosed
WO-2015017610-A1 SYK INHIBITORS GILEAD SCIENCES, INC. (US) 2015-02-05 — — WO disclosed
WO-2015017610-A1 SYK INHIBITORS GILEAD SCIENCES, INC. (US) 2015-02-05 — — WO disclosed
US-20150038488-A1 SYK INHIBITORS Kronos Bio, Inc. 2015-02-05 — — 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 (3 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-20150038488-A1 SYK INHIBITORS SYK, BTK, LYN PDE4B 1658/4885MAPT 4092/4885TSHR 2354/4885
US-20160368918-A1 SYK INHIBITORS SYK, BTK, LYN PDE4B 1728/4885MAPT 4131/4885TSHR 2383/4885
US-10005774-B2 Syk inhibitors SYK, BTK, LYN PDE4B 1728/4885MAPT 4131/4885TSHR 2383/4885

“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.

Send feedback