SCHEMBL23320400

SCHEMBL23320400

CC(NC(=O)Nc1ccc2nc(-c3ccccc3)oc2c1)c1ccncc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.66
▸ CASP3 P42574 1/20 0.62
▸ SENP8 Q96LD8 1/20 0.62
▸ SENP7 Q9BQF6 1/20 0.62
▸ SENP6 Q9GZR1 1/20 0.62
▸ ALDH1A1 P00352 7/20 0.54
▸ POLB P06746 4/20 0.54
▸ MAPT P10636 3/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ TSHR P16473 2/20 0.54
▸ LMNA P02545 1/20 0.54
▸ MAPK1 P28482 1/20 0.54
▸ NPC1 O15118 5/20 0.53
▸ RAB9A P51151 5/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ KDM4E B2RXH2 4/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.52

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
SCHEMBL15597459 0.81 CASP3 (0.61) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL23320381 0.79 NAMPT (1.00) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL26932280 0.78 CASP3 (0.73) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL29802221 0.78 CASP3 (0.73) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL23320402 0.78 NAMPT (0.81) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL16817733 0.78 NAMPT (0.65) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL2248517 0.77 SMN1; SMN2 (0.72) CASP3SENP8SENP7SENP6ALDH1A1
SCHEMBL29802104 0.76 CASP3 (0.70) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL26932215 0.76 CASP3 (0.70) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL29802090 0.76 CASP3 (0.70) NAMPTCASP3SENP8SENP7SENP6

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-3818053-A1 FUSED RING COMPOUND HAVING UREA STRUCTURE Sanford Burnham Prebys Medical Discovery Institute (US) 2021-05-12 — — EP claimed
EP-3818053-A1 FUSED RING COMPOUND HAVING UREA STRUCTURE Sanford Burnham Prebys Medical Discovery Institute (US) 2021-05-12 — — EP disclosed
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