SCHEMBL4763261

SCHEMBL4763261

CC(CCOC(=O)c1sc(Nc2ccccc2)nc1C)=C(F)F

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.69
RAB9A P51151 7/20 0.69
NPC1 O15118 7/20 0.69
HPGD P15428 2/20 0.69
KDM4E B2RXH2 4/20 0.57
ALDH1A1 P00352 4/20 0.57
LMNA P02545 1/20 0.57
DHODH Q02127 7/20 0.55
NPSR1 Q6W5P4 2/20 0.55
POLB P06746 1/20 0.54
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CYP2C9 P11712 1/20 0.47

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
SCHEMBL4763370 0.91 KDM4E (0.60) MAPTRAB9ANPC1HPGDKDM4E
SCHEMBL4762386 0.89 MAPT (0.60) MAPTRAB9ANPC1HPGDKDM4E
SCHEMBL4763532 0.86 MAPT (0.54) MAPTRAB9ANPC1HPGDKDM4E
SCHEMBL4763613 0.85 MAPT (0.68) MAPTRAB9ANPC1HPGDKDM4E
SCHEMBL2885791 0.82 MAPT (1.00) MAPTRAB9ANPC1HPGDKDM4E
Dimethylamine SCHEMBL4762229 0.81 SMN1; SMN2 (0.53) MAPTRAB9ANPC1HPGDALDH1A1
SCHEMBL4767637 0.81 SMN1; SMN2 (0.54) MAPTRAB9ANPC1HPGDALDH1A1
SCHEMBL4762410 0.80 CA12 (0.57) MAPTRAB9ANPC1HPGDLMNA
SCHEMBL4765999 0.79 SMN1; SMN2 (0.48) MAPTRAB9ANPC1HPGDKDM4E
SCHEMBL4765587 0.78 RAB9A (0.41) MAPTRAB9ANPC1HPGDKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1439169-B1 DIFLUOROALKENE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE SAME, AND INTERMEDIATE THEREFOR KUMIAI CHEMICAL INDUSTRY CO (JP) 2008-08-06 EP disclosed
US-7273878-B2 Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2007-09-25 US disclosed
US-20040248872-A1 Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2004-12-09 US disclosed
EP-1439169-A1 DIFLUOROALKENE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE SAME, AND INTERMEDIATE THEREFOR KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2004-07-21 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-20040248872-A1 Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor DDT, WEE1, NOTUM MAPT 4388/4885RAB9A 838/4885NPC1 2528/4885

“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.