SCHEMBL791025

SCHEMBL791025

Cc1[c]cc(C(F)(F)F)cn1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AGBL2 Q5U5Z8 1/20 0.36
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
APAF1 O14727 1/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HPGD P15428 1/20 0.31
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
XPO1 O14980 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL459127 0.77 KIF11 (0.46) ALDH1A1KDM4EHPGD
SCHEMBL6654574 0.76 KMT2A (0.33) AGBL2KMT2ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL5142181 0.76 KMT2A (0.33) AGBL2KMT2ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL28713868 0.74 NOS3 (0.36) KMT2ASMN1; SMN2ALDH1A1KDM4EPOLB
SCHEMBL790734 0.74 ALDH1A1 (0.40) KMT2ASMN1; SMN2ALDH1A1KDM4EMAPT
SCHEMBL28887006 0.74 KIF11 (0.33) AGBL2KMT2APOLB
SCHEMBL21810854 0.74 SMN1; SMN2 (0.37) AGBL2KMT2ASMN1; SMN2KDM4EMAPT
SCHEMBL932697 0.70
SCHEMBL8894256 0.69 AGBL2 (0.41) AGBL2KMT2ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL193940 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2615917-A2 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS III BASF SE (DE) 2013-07-24 EP disclosed
US-20130180014-A1 Pyridine Compounds for Controlling Invertebrate Pests III BASF SE (DE) 2013-07-11 US disclosed
WO-2012034959-A2 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS III BASF SE (DE) 2012-03-22 WO 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-20130180014-A1 Pyridine Compounds for Controlling Invertebrate Pests III CHRM1, CHRM2, GRIN2C AGBL2 4165/4885KMT2A 1030/4885SMN1; SMN2 1928/4885

“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.