SCHEMBL19848264

SCHEMBL19848264

COCn1nnc2ccc(C#N)cc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 7/20 0.41
CYP11B1 P15538 5/20 0.41
KMT2A Q03164 1/20 0.40
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HIF1A Q16665 1/20 0.39
GLA P06280 1/20 0.37
TSHR P16473 1/20 0.37
ACSS2 Q9NR19 1/20 0.36
SLC9A1 P19634 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HCAR3 P49019 1/20 0.34
BRD4 O60885 1/20 0.33
KMO O15229 1/20 0.33

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
SCHEMBL19848567 0.88 HCAR3 (0.42) CYP11B2CYP11B1KMT2AMAPTKDM4E
SCHEMBL6187558 0.83 SLC9A1 (0.53) CYP11B2CYP11B1KMT2AMAPTKDM4E
SCHEMBL19915656 0.81 SLC9A1 (0.55) CYP11B2CYP11B1GLATSHRACSS2
SCHEMBL19848267 0.80 TSHR (0.43) CYP11B2CYP11B1KMT2AMAPTKDM4E
SCHEMBL29342227 0.79 MAPT (0.44) CYP11B2CYP11B1KMT2AJAK2JAK3
SCHEMBL19911489 0.78 POLB (0.44) KMT2AMAPTKDM4ESLC9A1ALDH1A1
SCHEMBL19848442 0.78 SLC9A1 (0.57) CYP11B2CYP11B1GLATSHRACSS2
SCHEMBL19848443 0.78 KDM4E (0.39) CYP11B2CYP11B1KMT2AMAPTKDM4E
SCHEMBL19848209 0.77 HDAC3 (0.47) KMT2AMAPTKDM4ESLC9A1ALDH1A1
SCHEMBL19848606 0.77 GRM2 (0.42) KMT2AKDM4ESLC9A1HCAR3KMO

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
EP-3279997-A1 NONAQUEOUS ELECTROLYTE AND NONAQUEOUS SECONDARY BATTERY Asahi Kasei Kabushiki Kaisha (JP) 2018-02-07 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 (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 CYP11B2 607/4885CYP11B1 640/4885KMT2A 458/4885
US-20180062213-A1 Nonaqueous Electrolyte and Nonaqueous Secondary Battery BPTF, BRD4, KCNN2 CYP11B2 607/4885CYP11B1 640/4885KMT2A 458/4885

“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.