SCHEMBL19915917

SCHEMBL19915917

CCCn1c(Cc2cc3ncn(C(C)(C)C)c3cc2C)nc2cc(C)c(C)cc21

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 3/20 0.39
GAA P10253 3/20 0.39
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 5/20 0.34
TP53 P04637 4/20 0.34
POLB P06746 2/20 0.34
THRB P10828 1/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
FABP6 P51161 1/20 0.34

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
SCHEMBL16154685 0.75 POLB (0.47) LMNAALDH1A1KDM4EGAAMEN1
SCHEMBL19915931 0.75 NPC1 (0.48) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL20253184 0.64 MAPT (0.48) LMNAALDH1A1KDM4EGAAMEN1
SCHEMBL15779866 0.64 LMNA (0.81) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL22883424 0.59 MAPT (0.48) LMNAALDH1A1KDM4EGAAMEN1
SCHEMBL15907151 0.59 NPC1 (0.41) LMNAALDH1A1KDM4EGAAMEN1
SCHEMBL4930316 0.59 HDAC1 (0.42) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL4930303 0.59 HDAC1 (0.42) ALDH1A1KDM4EGAAMEN1KMT2A
SCHEMBL19911300 0.59 LMNA (1.00) LMNAALDH1A1KDM4EGAAMEN1
SCHEMBL20906884 0.59 MEN1 (0.71) LMNAALDH1A1KDM4EGAAMEN1

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 LMNA 1033/4885ALDH1A1 3497/4885KDM4E 2256/4885
US-20180062213-A1 Nonaqueous Electrolyte and Nonaqueous Secondary Battery BPTF, BRD4, KCNN2 LMNA 1033/4885ALDH1A1 3497/4885KDM4E 2256/4885

“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.