SCHEMBL30146604

SCHEMBL30146604

[2H]c1cnnc(N2CCNC(C)C2)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 3/20 0.40
PRKCD Q05655 1/20 0.40
CSNK1E P49674 2/20 0.38
ACVR1 Q04771 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
KIT P10721 1/20 0.37
HTR2C P28335 1/20 0.36
MAPK13 O15264 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
MAPK14 Q16539 1/20 0.36
CDK4 P11802 3/20 0.36
CDK6 Q00534 3/20 0.36
HDAC1 Q13547 1/20 0.36
ROCK1 Q13464 2/20 0.35
KHK P50053 1/20 0.35
NMT1 P30419 1/20 0.35

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
SCHEMBL32685342 0.85 PRKCQ (0.49) PRKCQPRKCDCSNK1EACVR1KIT
SCHEMBL32685347 0.85 PRKCQ (0.49) PRKCQPRKCDCSNK1EACVR1KIT
SCHEMBL32685344 0.85 PRKCQ (0.49) PRKCQPRKCDCSNK1EACVR1KIT
SCHEMBL30146642 0.79 PRKCQ (0.47) PRKCQPRKCDCSNK1EACVR1KIT
SCHEMBL20038332 0.73 HDAC1 (0.42) PRKCQPRKCDCSNK1EACVR1ALDH1A1
SCHEMBL30426817 0.73 HDAC1 (0.45) PRKCQPRKCDCSNK1EACVR1KIT
SCHEMBL9214403 0.73 BPTF (0.61) ALDH1A1LMNA
SCHEMBL31745447 0.71 PLD1 (0.60) PRKCQPRKCDCSNK1EACVR1ALDH1A1
SCHEMBL30534242 0.71 ROCK2 (0.42) PRKCQPRKCDACVR1ALDH1A1KIT
SCHEMBL234735 0.71 PLD1 (0.60) PRKCQPRKCDCSNK1EACVR1ALDH1A1

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-20250179059-A1 ANTICANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2025-06-05 US disclosed
US-12162870-B2 Anticancer compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-12-10 US disclosed
US-20230025178-A1 ANTICANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-01-26 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 (3 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-20250179059-A1 ANTICANCER COMPOUNDS BET1, BRD4, BICRA PRKCQ 3010/4885PRKCD 3635/4885CSNK1E 1060/4885
US-20230025178-A1 ANTICANCER COMPOUNDS BET1, BRD4, BICRA PRKCQ 3010/4885PRKCD 3635/4885CSNK1E 1060/4885
US-12162870-B2 Anticancer compounds BET1, BRD4, BICRA PRKCQ 3010/4885PRKCD 3635/4885CSNK1E 1060/4885

“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.