SCHEMBL21361032

SCHEMBL21361032

CC(C)N[C@@H]1CCCNCC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.41
PIM1 P11309 1/20 0.35
KCNH2 Q12809 1/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GNAI3 P08754 2/20 0.33
GNAO1 P09471 2/20 0.33
GNAI1 P63096 2/20 0.33
POLB P06746 1/20 0.33
KDM1A O60341 1/20 0.30
EHMT2 Q96KQ7 1/20 0.30
SOS1 Q07889 1/20 0.30
DPP7 Q9UHL4 1/20 0.30

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
SCHEMBL13503179 1.00 EPHX1 (0.41) EPHX1PIM1KCNH2GAAL3MBTL1
SCHEMBL23365995 0.95 GAA (0.36) EPHX1PIM1GAAL3MBTL1
SCHEMBL2106218 0.93 EPHX1 (0.41) EPHX1KCNH2GAAL3MBTL1GNAI3
Hydrochloric Acid SCHEMBL6016942 0.91 GNAI3 (0.39) EPHX1KCNH2GAAL3MBTL1GNAI3
Hydrochloric Acid SCHEMBL3413064 0.91 GNAI3 (0.39) EPHX1KCNH2GAAL3MBTL1GNAI3
Bicarbonate SCHEMBL3920858 0.83 EPHX1 (0.48) EPHX1GAAL3MBTL1GNAI3GNAO1
SCHEMBL7327965 0.82 KCNH2 (0.39) KCNH2KDM1A
SCHEMBL15016647 0.82 KCNH2 (0.39) KCNH2KDM1A
SCHEMBL12258977 0.82 KCNH2 (0.39) KCNH2KDM1A
SCHEMBL3980551 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10414763-B2 Azaquinazoline inhibitors of atypical protein kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-09-17 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 (1 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-10414763-B2 Azaquinazoline inhibitors of atypical protein kinase C PRKCQ, PRKCA, PRKCZ EPHX1 4049/4885PIM1 619/4885KCNH2 1301/4885

“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.