SCHEMBL4768683

SCHEMBL4768683

CC(CCCCOC(=O)c1sc(Oc2ccccc2)nc1C)=C(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.39
NPC1 O15118 7/20 0.39
MAPT P10636 5/20 0.39
HPGD P15428 3/20 0.39
SMN1; SMN2 Q16637 5/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 4/20 0.39
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
CYP2C9 P11712 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
LMNA P02545 2/20 0.36
DHODH Q02127 1/20 0.36
KDM4E B2RXH2 2/20 0.36
P2RX3 P56373 2/20 0.36
APOBEC3G Q9HC16 1/20 0.36
POLB P06746 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
CASP3 P42574 1/20 0.35

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
SCHEMBL4767289 0.83 SMN1; SMN2 (0.51) RAB9ANPC1MAPTHPGDSMN1; SMN2
SCHEMBL4765315 0.81 TSHR (0.42) RAB9ANPC1MAPTHPGDSMN1; SMN2
SCHEMBL4767766 0.81 SMN1; SMN2 (0.46) RAB9ANPC1MAPTHPGDSMN1; SMN2
SCHEMBL4771473 0.80 NPC1 (0.45) RAB9ANPC1MAPTHPGDSMN1; SMN2
SCHEMBL2885006 0.79 NPC1 (0.59) RAB9ANPC1MAPTHPGDSMN1; SMN2
SCHEMBL4763860 0.78 TRPM8 (0.43) RAB9ANPC1MAPTHPGDSMN1; SMN2
SCHEMBL4765630 0.78 MAPT (0.47) RAB9ANPC1MAPTHPGDSMN1; SMN2
SCHEMBL4768906 0.77 CDC7 (0.48) RAB9ANPC1MAPTSMN1; SMN2ALDH1A1
SCHEMBL4763721 0.77 KDM4E (0.42) RAB9ANPC1MAPTHPGDSMN1; SMN2
SCHEMBL4763597 0.77 TSHR (0.41) RAB9ANPC1MAPTHPGDSMN1; 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 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 RAB9A 838/4885NPC1 2528/4885MAPT 4388/4885

“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.