SCHEMBL14396776

SCHEMBL14396776

CCN(CC)CCn1cc(-c2cc(Oc3ccc4nc(N)sc4c3)ccn2)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 13/20 0.52
▸ PIK3CA P42336 13/20 0.52
▸ PI4KA P42356 13/20 0.52
▸ PI4KB Q9UBF8 13/20 0.52
▸ PIK3CG P48736 12/20 0.52
▸ PIK3CB P42338 11/20 0.52
▸ PIP5K1C O60331 3/20 0.52
▸ CYP3A4 P08684 3/20 0.44
▸ TP53 P04637 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ NPC1 O15118 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ LMNA P02545 1/20 0.39

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
SCHEMBL14397009 0.90 PIK3CD (0.64) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL14396768 0.88 PIK3CD (0.63) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL14397011 0.87 PIK3CD (0.52) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL14396769 0.86 PIK3CA (0.52) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL14396839 0.86 PIK3CD (0.51) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL14396831 0.83 PIK3CD (0.61) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL14396840 0.82 PIK3CD (0.47) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL14397004 0.82 PIK3CA (0.46) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL2677446 0.81 CSF1R (0.35) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL2677445 0.81 CSF1R (0.35) PIK3CDPIK3CAPI4KAPI4KBPIK3CG

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-2007121484-A2 6-O-SUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE COMPOUNDS AND METHODS OF INHIBITING CSF-1R SIGNALING NOVARTIS AG (CH) 2007-10-25 — — WO disclosed
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