SCHEMBL5843519

SCHEMBL5843519

CC(=NNc1ccc(C(F)(F)F)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.49
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
DHODH Q02127 1/20 0.46
ALDH1A1 P00352 3/20 0.45
TRPV1 Q8NER1 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 2/20 0.44
GAA P10253 1/20 0.44
PKM P14618 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
ATM Q13315 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GLA P06280 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
AKR1C3 P42330 1/20 0.43

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
SCHEMBL11673398 0.81 MAPT (0.59) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL518630 0.81 EPHX2 (0.50) EPHX2RAB9ANPC1DHODHALDH1A1
SCHEMBL23540865 0.81 ALDH1A1 (0.50) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL11672882 0.81 ALDH1A1 (0.50) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL17803166 0.80 EPHX2 (0.49) EPHX2RAB9ANPC1ALDH1A1TRPV1
SCHEMBL17803167 0.80 EPHX2 (0.49) EPHX2RAB9ANPC1ALDH1A1TRPV1
SCHEMBL5843881 0.79 NPSR1 (0.58) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL9429111 0.79 TDP1 (0.48) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL9429115 0.79 TDP1 (0.48) RAB9ANPC1ALDH1A1MEN1KMT2A
SCHEMBL3089956 0.78 GFER (0.60) RAB9ANPC1ALDH1A1MEN1KMT2A

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
US-7153815-B2 Insecticide containing hydrazone derivative as the active ingredient and novel hydrazone derivative NIHON NOHYAKU CO., LTD. (JP) 2006-12-26 US disclosed
US-20050203149-A1 Insecticide containing hydrazone derivatives as the active ingredient and novel hydrazone derivates NIHON NOHYAKU CO., LTD (JP) 2005-09-15 US disclosed
EP-1470752-A1 INSECTICIDES CONTAINING HYDRAZONE DERIVATIVES AS THE ACTIVE INGREDIENT AND NOVEL HYDRAZONE DERIVATIVES Nihon Nohyaku Co., Ltd. (JP) 2004-10-27 EP disclosed
US-4008217-A HERBICIDE THE UPJOHN COMPANY (US) 1977-02-15 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-20050203149-A1 Insecticide containing hydrazone derivatives as the active ingredient and novel hydrazone derivates DDT, AOX1, HAX1 EPHX2 1242/4885RAB9A 3544/4885NPC1 4324/4885

“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.