SCHEMBL10453870

SCHEMBL10453870

CCOC(=O)c1nc(C)oc1/N=N/c1c(C)nn(-c2cc(-n3nc(C)c(/N=N/c4oc(C)nc4C(=O)OC)c3N)ncn2)c1N

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ SLC34A1 Q06495 7/20 0.35
▸ THRB P10828 1/20 0.34
▸ NPC1 O15118 3/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33

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
SCHEMBL12506760 0.80 — —
SCHEMBL10454158 0.78 MAPT (0.38) MAPTCYP1A2CYP2C19RECQLSMN1; SMN2
SCHEMBL10453721 0.76 HPGD (0.38) MAPTCYP1A2CYP2C19RECQLSMN1; SMN2
SCHEMBL10452822 0.76 MAPT (0.38) MAPTCYP1A2CYP2C19RECQLSMN1; SMN2
SCHEMBL12414818 0.75 MAPT (0.36) MAPTCYP1A2CYP2C19RECQLSMN1; SMN2
SCHEMBL10453678 0.74 GAA (0.38) MAPTCYP1A2CYP2C19RECQLSMN1; SMN2
SCHEMBL12414821 0.73 HPGD (0.34) MAPTLMNANPC1RAB9AALDH1A1
SCHEMBL10454090 0.73 NPC1 (0.50) MAPTCYP1A2CYP2C19RECQLSMN1; SMN2
SCHEMBL10233992 0.73 MAPT (0.34) MAPTLMNANPC1RAB9AALDH1A1
SCHEMBL10454157 0.72 NPC1 (0.40) MAPTCYP1A2CYP2C19RECQLSMN1; 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
US-8222326-B2 Water-based ink composition for inkjet recording FUJIFILM CORPORATION (JP) 2012-07-17 — — US disclosed
US-20100160504-A1 WATER-BASED INK COMPOSITION FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2010-06-24 — — US disclosed
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