SCHEMBL19911484

SCHEMBL19911484

CCCn1nnc2ccc(C)cc21

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 6/20 0.62
HCAR3 P49019 3/20 0.50
POLB P06746 2/20 0.48
RAB9A P51151 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GRM2 Q14416 1/20 0.44
TLR8 Q9NR97 1/20 0.43
KMO O15229 1/20 0.43
GAA P10253 1/20 0.43
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL19911481 0.90 SLC9A1 (0.64) SLC9A1HCAR3POLBRAB9AKMT2A
SCHEMBL19911469 0.86 SLC9A1 (0.62) SLC9A1HCAR3POLBRAB9AKMT2A
SCHEMBL19848207 0.86 SLC9A1 (0.59) SLC9A1HCAR3POLBRAB9AKMT2A
SCHEMBL17103044 0.82 SLC9A1 (0.62) SLC9A1HCAR3POLBRAB9AKMT2A
SCHEMBL31642496 0.81 SLC9A1 (0.60) SLC9A1HCAR3RAB9AKMT2AMEN1
SCHEMBL19911629 0.81 SLC9A1 (0.60) SLC9A1HCAR3POLBRAB9AKMT2A
SCHEMBL19911601 0.81 SLC9A1 (0.60) SLC9A1HCAR3RAB9AKMT2AMEN1
SCHEMBL19911491 0.81 POLB (0.43) SLC9A1POLBRAB9AKMT2AMEN1
SCHEMBL19911498 0.80 SLC9A1 (0.50) SLC9A1HCAR3POLBRAB9AKMT2A
SCHEMBL19911514 0.79 SLC9A1 (0.57) SLC9A1HCAR3RAB9AKMT2AMEN1

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
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
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 SLC9A1 341/4885HCAR3 4636/4885POLB 118/4885
US-20180062213-A1 Nonaqueous Electrolyte and Nonaqueous Secondary Battery BPTF, BRD4, KCNN2 SLC9A1 341/4885HCAR3 4636/4885POLB 118/4885

“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.