SCHEMBL7035643

SCHEMBL7035643

Cn1c(F)[c]c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.39
F12 P00748 1/20 0.35
MAPT P10636 2/20 0.33
ATM Q13315 2/20 0.33
KDM4E B2RXH2 1/20 0.33
CA12 O43570 2/20 0.32
CA9 Q16790 2/20 0.32
ALDH1A1 P00352 2/20 0.32
BRD4 O60885 1/20 0.32
BRPF1 P55201 1/20 0.32
KAT2B Q92831 1/20 0.32
BRD9 Q9H8M2 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPC1 O15118 2/20 0.32
TSHR P16473 2/20 0.32
ERAP1 Q9NZ08 1/20 0.32
PSMB8 P28062 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
KIF11 P52732 1/20 0.31

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
SCHEMBL700437 0.76 GPR3 (0.41) GPR3F12MAPTATMKDM4E
SCHEMBL7036048 0.74 SMN1; SMN2 (0.41) GPR3F12MAPTATMCA12
SCHEMBL7838631 0.71 GPR3 (0.37) GPR3MAPTKDM4ECA12CA9
SCHEMBL2704346 0.71 KMT2A (0.40) GPR3KDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL4014784 0.67 ALDH1A1 (0.35) GPR3MAPTATMKDM4EALDH1A1
SCHEMBL2115649 0.67 CYP19A1 (0.48) MAPTKDM4EALDH1A1SMN1; SMN2TSHR
SCHEMBL7299415 0.67 EGFR (0.41) GPR3MAPTKDM4EALDH1A1BRD4
SCHEMBL695274 0.64 ALDH1A1 (0.41) MAPTKDM4EALDH1A1NPC1ERAP1
SCHEMBL193935 0.64 GPR3 (0.37) GPR3MAPTKDM4ECA12CA9
SCHEMBL9312817 0.63 CA12 (0.47) GPR3MAPTKDM4ECA12CA9

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-20030212116-A1 Heterocyclic imino compounds and fungicides and insecticides for agricultural and horitcultural use NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2003-11-13 US disclosed
EP-1243580-A1 HETEROCYCLIC IMINO COMPOUNDS AND FUNGICIDES AND INSECTICIDES FOR AGRICULTURAL AND HORTICULTURAL USE Nissan Chemical Industries, Ltd. (JP) 2002-09-25 EP 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-20030212116-A1 Heterocyclic imino compounds and fungicides and insecticides for agricultural and horitcultural use DDT, CBR3, CYP1B1 GPR3 3566/4885F12 1787/4885MAPT 4723/4885

“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.