SCHEMBL2917895

SCHEMBL2917895

CCOC(=O)CCC(=O)c1cnccn1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.51
TSHR P16473 2/20 0.51
SMN1; SMN2 Q16637 5/20 0.48
NPC1 O15118 5/20 0.48
RAB9A P51151 5/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 3/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
NAPRT Q6XQN6 1/20 0.44
HCAR2 Q8TDS4 1/20 0.44
HPGD P15428 1/20 0.44
ADORA3 P0DMS8 1/20 0.43
MC4R P32245 1/20 0.43
ADRA1A P35348 1/20 0.43
MC3R P41968 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43

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
SCHEMBL509677 0.86 POLB (0.52) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL17884923 0.80 POLB (0.44) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL9946197 0.80 KDM4E (0.53) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL30568667 0.78 POLB (0.61) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL2558377 0.78 POLB (0.61) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL6158035 0.78 CTNNB1 (0.61) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL11530756 0.77 NPC1 (0.43) POLBTSHRSMN1; SMN2NPC1RAB9A
Hydrochloric Acid SCHEMBL11372856 0.77 CTNNB1 (0.60) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL2917891 0.77 NPC1 (0.50) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL11827583 0.76 CYP2D6 (0.47) POLBTSHRSMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326766-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2025-10-23 US disclosed
WO-2025106362-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2025-05-22 WO disclosed
EP-4526300-A1 RIPK1 INHIBITORS AND METHODS OF USE Merck Sharp & Dohme LLC (US) 2025-03-26 EP disclosed
US-20240025912-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-01-25 US disclosed
US-20240025912-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-01-25 US disclosed
US-20240025912-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-01-25 US disclosed
WO-2023225041-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2023-11-23 WO disclosed
WO-2023225041-A1 RIPK1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2023-11-23 WO disclosed
EP-1591443-B1 PYRAZOLE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2010-08-25 EP disclosed
US-7622471-B2 Pyrazole derivatives having a pyridazine and pyridine functionality DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-11-24 US disclosed
US-20060128685-A1 Pyrazole derivative DAIICHI PHARMACEUTICAL CO., LTD., (JP) 2006-06-15 US disclosed
EP-1591443-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-02 EP 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-20240025912-A1 RIPK1 INHIBITORS AND METHODS OF USE RIPK1, RIPK2, RIPK3 POLB 3131/4885TSHR 4273/4885SMN1; SMN2 1667/4885
US-20060128685-A1 Pyrazole derivative PTGS1, PTGS2, PTGER1 POLB 3329/4885TSHR 4631/4885SMN1; SMN2 3778/4885
US-20250326766-A1 RIPK1 INHIBITORS AND METHODS OF USE RIPK1, RIPK2, RIPK3 POLB 3213/4885TSHR 4246/4885SMN1; SMN2 1414/4885

“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.