SCHEMBL24485239

SCHEMBL24485239

CC(C)CC(=O)Nc1ccc(CCc2ccc(NC(=O)CC(C)C)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.79
SMN1; SMN2 Q16637 4/20 0.79
NPC1 O15118 2/20 0.79
PTPN1 P18031 2/20 0.73
HPGD P15428 2/20 0.65
LMNA P02545 2/20 0.65
MAPT P10636 1/20 0.58
MAPK1 P28482 1/20 0.58
GAA P10253 1/20 0.57
ALDH1A1 P00352 1/20 0.55
KDM4E B2RXH2 1/20 0.54
TSHR P16473 1/20 0.54
MTNR1B P49286 1/20 0.51
NAMPT P43490 1/20 0.51
POLB P06746 1/20 0.50

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
SCHEMBL15395899 0.91 RAB9A (0.72) RAB9ASMN1; SMN2NPC1PTPN1HPGD
SCHEMBL21765873 0.90 PTPN1 (0.88) RAB9ASMN1; SMN2NPC1PTPN1HPGD
SCHEMBL13129132 0.89 PTPN1 (0.73) RAB9ASMN1; SMN2NPC1PTPN1HPGD
SCHEMBL8434001 0.87 SMN1; SMN2 (0.72) RAB9ASMN1; SMN2NPC1PTPN1HPGD
SCHEMBL8250876 0.87 PTPN1 (0.71) RAB9ASMN1; SMN2NPC1PTPN1HPGD
SCHEMBL14032492 0.86 RAB9A (0.74) RAB9ASMN1; SMN2NPC1PTPN1HPGD
SCHEMBL19525769 0.86 PTPN1 (0.69) RAB9ASMN1; SMN2NPC1PTPN1HPGD
SCHEMBL13893279 0.85 RAB9A (0.63) RAB9ASMN1; SMN2NPC1PTPN1HPGD
SCHEMBL14032233 0.84 PTPN1 (0.67) RAB9ASMN1; SMN2NPC1PTPN1HPGD
SCHEMBL8361578 0.83 PTPN1 (0.76) RAB9ASMN1; SMN2NPC1PTPN1HPGD

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
WO-2022114072-A1 CRYSTALLIZATION INHIBITOR FOR POLYOLEFIN RESIN, POLYOLEFIN RESIN COMPOSITION, MOLDED ARTICLE, METHOD FOR PRODUCING POLYOLEFIN RESIN COMPOSITION, AND METHOD FOR INHIBITING CRYSTALLIZATION OF POLYOLEFIN RESIN 株式会社ADEKA 2022-06-02 WO disclosed