SCHEMBL30142483

SCHEMBL30142483

CN(C)[C@H](CCNC(=O)N1Cc2ccc(F)cc2C1)c1ccsc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 17/20 0.48
ACKR3 P25106 1/20 0.47
CHRNB2 P17787 1/20 0.43
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA4 P43681 1/20 0.43
DPP8 Q6V1X1 1/20 0.42
DPP9 Q86TI2 1/20 0.42

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
SCHEMBL19926202 1.00 NAMPT (0.48) NAMPTACKR3CHRNB2CHRNB4CHRNA3
SCHEMBL30142487 1.00 NAMPT (0.48) NAMPTACKR3CHRNB2CHRNB4CHRNA3
SCHEMBL19926258 1.00 NAMPT (0.48) NAMPTACKR3CHRNB2CHRNB4CHRNA3
SCHEMBL30142463 1.00 NAMPT (0.48) NAMPTACKR3CHRNB2CHRNB4CHRNA3
SCHEMBL19926201 1.00 NAMPT (0.48) NAMPTACKR3CHRNB2CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL19926014 0.99 NAMPT (0.47) NAMPTACKR3CHRNB2CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL19926188 0.99 NAMPT (0.47) NAMPTACKR3CHRNB2CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL19926015 0.99 NAMPT (0.47) NAMPTACKR3CHRNB2CHRNB4CHRNA3
SCHEMBL21116504 0.90 ACKR3 (0.56) NAMPTACKR3DPP8DPP9
SCHEMBL21116506 0.90 ACKR3 (0.56) NAMPTACKR3DPP8DPP9

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
CN-109843379-B Substituted ureas and methods of making and using the same 梅比斯发现公司 2022-12-30 CN disclosed