SCHEMBL21363653

SCHEMBL21363653

Cc1nc(N2CCOCC2)n2ncn(C(C)(C)C)c(=O)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.38
KMT2A Q03164 3/20 0.35
MAPT P10636 2/20 0.35
LMNA P02545 2/20 0.35
ALDH1A1 P00352 3/20 0.34
HSD17B10 Q99714 3/20 0.34
CYP1A2 P05177 2/20 0.34
USP2 O75604 1/20 0.34
TP53 P04637 1/20 0.34
STAT3 P40763 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TRPA1 O75762 3/20 0.33
PRKDC P78527 1/20 0.33
DPP4 P27487 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
BRD4 O60885 1/20 0.32
BRD9 Q9H8M2 1/20 0.32
CYP3A4 P08684 1/20 0.32
MEN1 O00255 2/20 0.32

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
SCHEMBL21363495 0.86 TRPA1 (0.41) KMT2ALMNAALDH1A1HSD17B10CYP1A2
SCHEMBL21363453 0.85 TRPA1 (0.42) ALDH1A1HSD17B10CYP1A2USP2TRPA1
SCHEMBL21363437 0.83 HTT (0.43) HTTKMT2AMAPTLMNAALDH1A1
SCHEMBL21363501 0.78 HTT (0.36) HTTKMT2AMAPTALDH1A1HSD17B10
SCHEMBL21363450 0.77 TRPA1 (0.45) TRPA1
SCHEMBL21363544 0.76 TRPA1 (0.42) ALDH1A1HSD17B10CYP1A2USP2TRPA1
Hydrochloric Acid SCHEMBL18742181 0.75 LMNA (0.38) HTTKMT2ALMNAALDH1A1TRPA1
SCHEMBL21363540 0.75 TRPA1 (0.37) TRPA1
SCHEMBL26155915 0.73 KMT2A (0.39) HTTKMT2AMAPTALDH1A1HSD17B10
SCHEMBL21363543 0.73 TRPA1 (0.34) LMNAALDH1A1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11655245-B2 Oxadiazole transient receptor potential channel inhibitors GENENTECH, INC. (US) 2023-05-23 US disclosed
US-11655245-B2 Oxadiazole transient receptor potential channel inhibitors GENENTECH, INC. (US) 2023-05-23 US disclosed
US-20230121700-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2023-04-20 US disclosed
US-20200308161-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2020-10-01 US disclosed
US-10710994-B2 Oxadiazole transient receptor potential channel inhibitors GENENTECH, INC. (US) 2020-07-14 US disclosed
US-20190284179-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS GENENTECH, INC. (US) 2019-09-19 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 (5 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-11655245-B2 Oxadiazole transient receptor potential channel inhibitors TRPA1, TRPV1, P2RX3 HTT 1248/4885KMT2A 4225/4885MAPT 2784/4885
US-20190284179-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, TRPV3 HTT 1243/4885KMT2A 4323/4885MAPT 2344/4885
US-20200308161-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, P2RX3 HTT 1248/4885KMT2A 4225/4885MAPT 2784/4885
US-10710994-B2 Oxadiazole transient receptor potential channel inhibitors TRPA1, TRPV1, TRPV3 HTT 1243/4885KMT2A 4323/4885MAPT 2344/4885
US-20230121700-A1 OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS TRPA1, TRPV1, TRPV3 HTT 1243/4885KMT2A 4323/4885MAPT 2344/4885

“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.