SCHEMBL685063

SCHEMBL685063

Cc1ccc(O)c(/C=N/NC(=O)c2cccc(F)c2)c1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.61
▸ RAB9A P51151 4/20 0.61
▸ MAPT P10636 4/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.61
▸ HPGD P15428 1/20 0.61
▸ HTT P42858 1/20 0.61
▸ KMT2A Q03164 4/20 0.60
▸ MEN1 O00255 3/20 0.60
▸ CYP1A2 P05177 2/20 0.59
▸ CYP3A4 P08684 2/20 0.59
▸ CYP2C19 P33261 2/20 0.59
▸ CYP2D6 P10635 1/20 0.59
▸ CYP2C9 P11712 1/20 0.59
▸ KDM1A O60341 3/20 0.58
▸ KDM4E B2RXH2 1/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ POLB P06746 2/20 0.56
▸ CTDSP1 Q9GZU7 1/20 0.56
▸ PIK3CG P48736 3/20 0.53

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
SCHEMBL26974383 0.90 RAB9A (0.62) NPC1RAB9AMAPTSMN1; SMN2HPGD
SCHEMBL685021 0.90 KDM1A (0.61) NPC1RAB9AMAPTSMN1; SMN2HTT
SCHEMBL684807 0.87 MAPT (0.64) NPC1RAB9AMAPTSMN1; SMN2HTT
SCHEMBL6569747 0.86 PIK3CG (0.62) NPC1RAB9AMAPTSMN1; SMN2HTT
SCHEMBL6569744 0.86 PIK3CG (0.62) NPC1RAB9AMAPTSMN1; SMN2HTT
SCHEMBL684973 0.86 PIK3CG (0.62) NPC1RAB9AMAPTSMN1; SMN2HTT
SCHEMBL684661 0.85 KDM1A (0.73) NPC1RAB9AMAPTSMN1; SMN2HPGD
SCHEMBL26974374 0.85 PIK3CG (0.65) NPC1RAB9AMAPTSMN1; SMN2HTT
SCHEMBL684998 0.85 RAB9A (0.76) NPC1RAB9AMAPTSMN1; SMN2HPGD
SCHEMBL12218406 0.85 KMT2A (0.65) NPC1RAB9AMAPTSMN1; SMN2HPGD

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-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-06-14 — — US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, SOD3 NPC1 1690/4885RAB9A 3846/4885MAPT 1491/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 NPC1 1052/4885RAB9A 3616/4885MAPT 921/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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