SCHEMBL14705686

SCHEMBL14705686

O=C(Nc1cnccc1OCC1CCNCC1)c1csc(-c2c(F)cccc2F)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 13/20 1.00
PIM2 Q9P1W9 13/20 1.00
PIM1 P11309 19/20 0.84

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
SCHEMBL14705843 0.95 PIM3 (0.91) PIM3PIM2PIM1
SCHEMBL14705650 0.92 PIM1 (1.00) PIM3PIM2PIM1
SCHEMBL14705391 0.90 PIM1 (1.00) PIM3PIM2PIM1
SCHEMBL14705695 0.87 PIM1 (1.00) PIM3PIM2PIM1
SCHEMBL14705388 0.87 PIM1 (0.91) PIM3PIM2PIM1
SCHEMBL14703239 0.87 PIM3 (0.77) PIM3PIM2PIM1
SCHEMBL17136332 0.85 PIM1 (0.76) PIM3PIM2PIM1
SCHEMBL17136307 0.85 PIM3 (0.73) PIM3PIM2PIM1
SCHEMBL14705399 0.84 PIM1 (0.93) PIM3PIM2PIM1
Hydrochloric Acid SCHEMBL18695469 0.84 PIM3 (0.72) PIM3PIM2PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116478152-A Small molecular marrow cell proliferation inhibitor and preparation method and application thereof 复旦大学 2023-07-25 CN disclosed
WO-2013020369-A1 PIM KINASE INHIBITOR, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL APPLICATION THEREOF 上海吉铠医药科技有限公司 (CN) 2013-02-14 WO disclosed