SCHEMBL11526196

SCHEMBL11526196

Cc1nc(NC(=O)NC(=O)c2c(Cl)cccc2Cl)cnc1C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 4/20 0.41
TYK2 P29597 4/20 0.41
TAS1R3 Q7RTX0 2/20 0.40
TAS1R1 Q7RTX1 2/20 0.40
TAS1R2 Q8TE23 2/20 0.40
JAK1 P23458 3/20 0.39
LCK P06239 1/20 0.38
CDK9 P50750 1/20 0.38
JAK3 P52333 1/20 0.38
SCN10A Q9Y5Y9 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 1/20 0.38
GHSR Q92847 1/20 0.38
RAB9A P51151 1/20 0.37
GRM5 P41594 1/20 0.37
P2RX7 Q99572 1/20 0.37
PPIA P62937 1/20 0.37
CNR1 P21554 1/20 0.36
ITGB1 P05556 1/20 0.36

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
SCHEMBL11372025 0.89 CCNA2 (0.42) TSHRSMN1; SMN2GHSRRAB9APPIA
SCHEMBL11520972 0.84 RAB9A (0.45) JAK2TYK2JAK1SMN1; SMN2MAPT
SCHEMBL11368780 0.81 NPC1 (0.46) SMN1; SMN2MAPTRAB9AGAA
SCHEMBL11521949 0.81 ABL1 (0.43) JAK2TYK2JAK1CDK9JAK3
SCHEMBL11520974 0.79 TYK2 (0.45) JAK2TYK2TAS1R3TAS1R1TAS1R2
SCHEMBL11523714 0.76 RAB9A (0.43) JAK2TYK2JAK1SMN1; SMN2MAPT
SCHEMBL11524573 0.76 RAB9A (0.46) JAK2TYK2JAK1CDK9JAK3
SCHEMBL11525837 0.75 CNR1 (0.42) JAK2TYK2JAK1SMN1; SMN2MAPT
SCHEMBL11526201 0.75 TYK2 (0.45) JAK2TYK2JAK1SMN1; SMN2MAPT
SCHEMBL11523661 0.75 MAPT (0.43) JAK2TYK2JAK1MAPTGHSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4160834-A INSECTICIDES ELI LILLY AND COMPANY (US) 1979-07-10 US disclosed