SCHEMBL22138702

SCHEMBL22138702

CC(=O)Nc1cnc2ccsc2c1C1CCCCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.39
MTOR P42345 1/20 0.39
CAMKK1 Q8N5S9 1/20 0.39
CAMKK2 Q96RR4 1/20 0.39
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
GLS O94925 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
AURKA O14965 1/20 0.37
AURKB Q96GD4 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 1/20 0.36
CCNE1 P24864 2/20 0.36
CDK2 P24941 2/20 0.36
CCNE2 O96020 1/20 0.36
NTRK1 P04629 2/20 0.35
MALT1 Q9UDY8 1/20 0.35
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35

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
SCHEMBL19059709 0.87 RAB9A (0.49) NPC1RAB9ASMN1; SMN2TSHRKMT2A
SCHEMBL18399540 0.87 RAB9A (0.49) NPC1RAB9ASMN1; SMN2TSHRKMT2A
SCHEMBL19059706 0.87 RAB9A (0.49) NPC1RAB9ASMN1; SMN2TSHRKMT2A
SCHEMBL18399536 0.87 RAB9A (0.49) NPC1RAB9ASMN1; SMN2TSHRKMT2A
SCHEMBL22018149 0.84 KDM4E (0.50) CAMKK1CAMKK2CYP2C9NPC1RAB9A
SCHEMBL22138677 0.78 MALT1 (0.54) CYP2D6CYP2C9GLSRAB9ACCNE1
SCHEMBL15883606 0.76 KDM4E (0.39) PIK3CAMTORALDH1A1MEN1KMT2A
SCHEMBL15883617 0.76 PIM2 (0.42) PIK3CAMTORALDH1A1MEN1KMT2A
SCHEMBL22138631 0.71 ADRA2A (0.37) CYP2D6CYP2C9GLSALDH1A1HSD17B10
SCHEMBL24831669 0.71 CCNE2 (0.36) CYP2D6CYP2C9GLSALDH1A1HSD17B10

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
EP-4186897-A1 PYRIDINECARBOXAMIDE COMPOUND USEFUL AS PIM KINASE INHIBITOR Incyte Holdings Corporation (US) 2023-05-31 EP disclosed
EP-3670506-A1 THIAZOLECARBOXAMIDES AND PYRIDINECARBOXAMIDE COMPOUNDS USEFUL AS PIM KINASE INHIBITORS Incyte Holdings Corporation (US) 2020-06-24 EP disclosed