SCHEMBL684473

SCHEMBL684473

C/C(=N\NC(=O)c1cccc(F)c1)c1ccccc1O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 2/20 0.77
KDM1A O60341 3/20 0.65
SMN1; SMN2 Q16637 6/20 0.59
RAB9A P51151 6/20 0.59
NPC1 O15118 5/20 0.59
MAPT P10636 6/20 0.58
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
LMNA P02545 4/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C19 P33261 1/20 0.58
KDM4E B2RXH2 5/20 0.57
HTT P42858 2/20 0.56
HPGD P15428 1/20 0.56
TSHR P16473 1/20 0.56
ALOX12 P18054 1/20 0.56
ALDH1A1 P00352 2/20 0.55
GAA P10253 2/20 0.55
PKM P14618 2/20 0.55
MCL1 Q07820 1/20 0.55

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
SCHEMBL28012829 0.86 KDM1A (0.81) MTORKDM1ASMN1; SMN2RAB9ANPC1
SCHEMBL685157 0.86 KDM1A (0.81) MTORKDM1ASMN1; SMN2RAB9ANPC1
SCHEMBL683725 0.85 KDM1A (0.67) MTORKDM1ASMN1; SMN2RAB9ANPC1
SCHEMBL684658 0.84 KDM1A (0.83) MTORKDM1ASMN1; SMN2RAB9ANPC1
SCHEMBL12316802 0.84 KDM1A (0.65) MTORKDM1ASMN1; SMN2RAB9ANPC1
SCHEMBL684535 0.84 KDM1A (0.65) MTORKDM1ASMN1; SMN2RAB9ANPC1
SCHEMBL684771 0.84 KDM1A (0.70) MTORKDM1ASMN1; SMN2RAB9AMAPT
SCHEMBL684770 0.84 NPC1 (0.69) MTORKDM1ASMN1; SMN2RAB9ANPC1
SCHEMBL12387768 0.82 KDM1A (0.74) MTORKDM1ASMN1; SMN2RAB9ANPC1
SCHEMBL685147 0.82 KDM1A (0.62) MTORKDM1ASMN1; SMN2RAB9ANPC1

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-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 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 (1 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 MTOR 2134/4885KDM1A 484/4885SMN1; SMN2 4107/4885

“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.