SCHEMBL19915877

SCHEMBL19915877

N#CCn1nnc2cc(C(F)(F)F)ccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.55
GRM2 Q14416 2/20 0.44
KCNMA1 Q12791 2/20 0.42
MAPT P10636 3/20 0.41
TSHR P16473 2/20 0.40
GLA P06280 1/20 0.40
ALDH1A1 P00352 3/20 0.38
USP2 O75604 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPK1 P28482 2/20 0.37
GAA P10253 1/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.36
AR P10275 2/20 0.36
PDE10A Q9Y233 1/20 0.36

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
SCHEMBL19915686 0.88 GRM2 (0.44) PKMGRM2KCNMA1MAPTTSHR
SCHEMBL19848184 0.85 PKM (0.55) PKMGRM2KCNMA1MAPTTSHR
SCHEMBL19848726 0.80 PKM (0.59) PKMGRM2KCNMA1MAPTALDH1A1
SCHEMBL19848325 0.80 TSHR (0.43) GRM2KCNMA1TSHRGLAALDH1A1
SCHEMBL19848725 0.78 PKM (0.56) PKMGRM2KCNMA1MAPTALDH1A1
SCHEMBL19848575 0.77 POLB (0.43) KCNMA1MAPTTSHRGLALMNA
SCHEMBL19915875 0.77 PKM (0.59) PKMGRM2KCNMA1MAPTALDH1A1
SCHEMBL19848569 0.77 TSHR (0.43) GRM2MAPTTSHRGLAALDH1A1
SCHEMBL19848353 0.77 KDM4E (0.46) GRM2MAPTTSHRGLALMNA
SCHEMBL19915658 0.77 PKM (0.55) PKMGRM2KCNMA1MAPTALDH1A1

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-10756394-B2 Nonaqueous electrolyte and nonaqueous secondary battery ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-08-25 US disclosed
US-20180062213-A1 Nonaqueous Electrolyte and Nonaqueous Secondary Battery ASAHI KASEI KABUSHIKI KAISHA (JP) 2018-03-01 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 (2 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-10756394-B2 Nonaqueous electrolyte and nonaqueous secondary battery BPTF, BRD4, KCNN2 PKM 2292/4885GRM2 2693/4885KCNMA1 525/4885
US-20180062213-A1 Nonaqueous Electrolyte and Nonaqueous Secondary Battery BPTF, BRD4, KCNN2 PKM 2292/4885GRM2 2693/4885KCNMA1 525/4885

“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.