SCHEMBL22436631

SCHEMBL22436631

CC1(C)COC(c2cccc(CCCCO)c2)OC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.41
CYP4A11 Q02928 2/20 0.41
SLC5A2 P31639 6/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SPHK2 Q9NRA0 3/20 0.37
SPHK1 Q9NYA1 2/20 0.37
S1PR3 Q99500 1/20 0.35
MEN1 O00255 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
LPL P06858 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
BCHE P06276 1/20 0.34
GAA P10253 1/20 0.33

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
SCHEMBL22436585 0.84 SMN1; SMN2 (0.42) SLC5A2NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL22436542 0.83 SMN1; SMN2 (0.45) CYP4F2CYP4A11SLC5A2NPC1RAB9A
SCHEMBL9518703 0.83 CYP4F2 (0.41) CYP4F2CYP4A11SLC5A2SPHK2SPHK1
SCHEMBL334828 0.79 MEN1 (0.40) CYP4F2CYP4A11SLC5A2NPC1RAB9A
SCHEMBL334680 0.77 NPC1 (0.45) NPC1RAB9ASMN1; SMN2MEN1CYP2C19
SCHEMBL7255668 0.73 NPC1 (0.45) NPC1RAB9ASMN1; SMN2MEN1CYP2C19
SCHEMBL9281772 0.73 TDP1 (0.41) CYP4F2CYP4A11SLC5A2SMN1; SMN2GAA
SCHEMBL22436578 0.72 NPC1 (0.43) NPC1RAB9ASMN1; SMN2MEN1CYP2C19
SCHEMBL9946117 0.71 KMT2A (0.44) NPC1RAB9ASMN1; SMN2MEN1CYP2C19
SCHEMBL22436579 0.71 HTR2C (0.43) NPC1RAB9ASMN1; SMN2MEN1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12024531-B2 Immunoproteasome inhibitors PRINCIPIA BIOPHARMA INC. (US) 2024-07-02 US disclosed
US-12024531-B2 Immunoproteasome inhibitors PRINCIPIA BIOPHARMA INC. (US) 2024-07-02 US disclosed
US-12024531-B2 Immunoproteasome inhibitors PRINCIPIA BIOPHARMA INC. (US) 2024-07-02 US disclosed
CN-111491939-B Immunoproteasome inhibitors 普林斯匹亚生物制药公司 2023-12-26 CN disclosed
US-20230133165-A1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC. 2023-05-04 US disclosed
US-20230133165-A1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC. 2023-05-04 US disclosed
US-20230133165-A1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC. 2023-05-04 US disclosed
EP-3710457-B1 IMMUNOPROTEASOME INHIBITORS PRINCIPIA BIOPHARMA INC (US) 2022-08-03 EP disclosed
EP-3710457-A1 IMMUNOPROTEASOME INHIBITORS Principia Biopharma, Inc. (US) 2020-09-23 EP disclosed
CN-111491939-A Immunoproteasome inhibitors 普林斯匹亚生物制药公司 2020-08-04 CN 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 (2 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-12024531-B2 Immunoproteasome inhibitors PSMC2, PSMB7, PSMB2 CYP4F2 3818/4885CYP4A11 2998/4885SLC5A2 4415/4885
US-20230133165-A1 IMMUNOPROTEASOME INHIBITORS PSMC2, PSMB7, PSMB2 CYP4F2 3818/4885CYP4A11 2998/4885SLC5A2 4415/4885

“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.