SCHEMBL25423141

SCHEMBL25423141

CCOC(=O)Cn1ccnc1NCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPID Q08752 1/20 0.49
▸ KDM4E B2RXH2 3/20 0.47
▸ FPR2 P25090 2/20 0.47
▸ RAB9A P51151 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ EED O75530 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ KMT2A Q03164 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP3A4 P08684 2/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ F2 P00734 1/20 0.42
▸ F10 P00742 1/20 0.42
▸ KLKB1 P03952 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

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
SCHEMBL25215406 0.83 CYP3A4 (0.48) KDM4EFPR2CYP3A4CYP2D6OPRK1
SCHEMBL17824294 0.77 CYP3A4 (0.49) KDM4ERAB9ASMN1; SMN2KMT2AALDH1A1
SCHEMBL22234295 0.77 ESR1 (0.57) KDM4EFPR2SMN1; SMN2KMT2AMEN1
SCHEMBL23461135 0.74 F2 (0.48) KDM4EFPR2KMT2AMEN1ALDH1A1
SCHEMBL18839661 0.73 L3MBTL1 (0.45) KDM4ERAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL20068591 0.73 FPR2 (0.47) KDM4EFPR2RAB9AKMT2AMEN1
SCHEMBL27967584 0.73 TMIGD3 (0.65) RAB9ASMN1; SMN2KMT2A
SCHEMBL368204 0.72 POLB (0.51) KDM4EFPR2SMN1; SMN2KMT2AMEN1
SCHEMBL16607262 0.72 LMNA (0.52) KDM4ERAB9AKMT2AMEN1ALDH1A1
SCHEMBL29156333 0.72 NPC1 (0.42) PPIDKDM4EFPR2RAB9ASMN1; SMN2

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
WO-2023096850-A1 PHOSPHOINOSITIDE 3 KINASE GAMMA INHIBITORS AND COMPOSITIONS AND METHODS THEREOF GEODE THERAPEUTICS INC. (US) 2023-06-01 — — WO disclosed
WO-2023096850-A1 PHOSPHOINOSITIDE 3 KINASE GAMMA INHIBITORS AND COMPOSITIONS AND METHODS THEREOF GEODE THERAPEUTICS INC. (US) 2023-06-01 — — WO disclosed
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