SCHEMBL24352253

SCHEMBL24352253

CC(C)NCc1ccccc1-c1ccnc(N)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 9/20 0.46
▸ CCNA2 P20248 9/20 0.46
▸ CDK2 P24941 9/20 0.46
▸ CDK9 P50750 9/20 0.46
▸ ADRA1D P25100 1/20 0.45
▸ ADRA1A P35348 1/20 0.45
▸ ADORA2A P29274 3/20 0.44
▸ AURKA O14965 1/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ PRKACA P17612 1/20 0.44
▸ CDK5 Q00535 7/20 0.42
▸ CDK5R1 Q15078 7/20 0.42
▸ DYRK1A Q13627 2/20 0.42
▸ CLK1 P49759 1/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ MAP3K14 Q99558 1/20 0.42
▸ CCNA1 P78396 6/20 0.41
▸ PDPK1 O15530 1/20 0.41
▸ FEN1 P39748 2/20 0.39
▸ ADRA2C P18825 1/20 0.38

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
SCHEMBL24352863 0.89 CCNT1 (0.44) CCNT1CCNA2CDK2CDK9ADRA1D
SCHEMBL28507020 0.79 CCNT1 (0.60) CCNT1CCNA2CDK2CDK9ADRA1D
SCHEMBL30507485 0.79 CCNT1 (0.60) CCNT1CCNA2CDK2CDK9ADRA1D
SCHEMBL23330116 0.78 TRPM8 (0.42) ADRA1DADRA1AADORA2AHSP90AA1ADRA2C
SCHEMBL24352862 0.78 CYP1A2 (0.42) ADORA2AADRA2C
SCHEMBL24352278 0.77 CASP6 (0.40) CCNT1CCNA2CDK2CDK9CDK5
SCHEMBL24352623 0.75 BCHE (0.38) FEN1ADRA2C
SCHEMBL24352251 0.75 ASIC3 (0.44) —
SCHEMBL24352625 0.75 ALOX5AP (0.40) FEN1ADRA2C
SCHEMBL24352279 0.74 ADRA1A (0.43) ADRA1DADRA1AADORA2AFEN1ADRA2C

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-20220119395-A1 BICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2022-04-21 — — 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-20220119395-A1 BICYCLIC COMPOUNDS SLC10A1, PKD1, CYP11B2 CCNT1 4076/4885CCNA2 3949/4885CDK2 2947/4885

“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.

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