SCHEMBL31292647

SCHEMBL31292647

Cn1ncc2ccc(CC#N)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CACNA1H O95180 5/20 0.44
▸ MPO P05164 1/20 0.43
▸ CYP1A2 P05177 1/20 0.41
▸ CCNC P24863 1/20 0.40
▸ CDK8 P49336 1/20 0.40
▸ NOTUM Q6P988 1/20 0.40
▸ LRRK2 Q5S007 1/20 0.39
▸ VNN1 O95497 1/20 0.39
▸ CTNNB1 P35222 1/20 0.39
▸ TCF7 P36402 1/20 0.39
▸ ERCC1 P07992 1/20 0.39
▸ ERCC4 Q92889 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ NAMPT P43490 1/20 0.38
▸ KDM2B Q8NHM5 1/20 0.38
▸ KDM4C Q9H3R0 1/20 0.38
▸ IRAK4 Q9NWZ3 1/20 0.38
▸ CTSC P53634 1/20 0.36
▸ PDE1C Q14123 1/20 0.36

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
SCHEMBL16406907 0.89 CTNNB1 (0.50) CACNA1HMPOCCNCCDK8VNN1
SCHEMBL8172855 0.79 MPO (0.47) CACNA1HMPOCYP1A2CCNCCDK8
SCHEMBL29426964 0.77 MPO (0.46) CACNA1HMPOCYP1A2CCNCCDK8
SCHEMBL29585470 0.77 MPO (0.49) CACNA1HMPOCCNCCDK8NOTUM
SCHEMBL30903411 0.77 NOTUM (0.52) CACNA1HMPOCCNCCDK8NOTUM
SCHEMBL24339179 0.77 MPO (0.46) CACNA1HMPOCYP1A2CCNCCDK8
SCHEMBL904805 0.77 MPO (0.49) CACNA1HMPOCCNCCDK8NOTUM
SCHEMBL14800197 0.77 NOTUM (0.52) CACNA1HMPOCCNCCDK8NOTUM
SCHEMBL7431709 0.76 CACNA1H (0.48) CACNA1HNOTUMERCC1ERCC4IRAK4
SCHEMBL13548299 0.76 CTNNB1 (0.47) CACNA1HMPOCYP1A2CCNCCDK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250340528-A1 TARGETED PROTEIN DEGRADATION MONTE ROSA THERAPEUTICS AG (CH) 2025-11-06 — — US disclosed
US-12459920-B2 Targeted protein degradation MONTE ROSA THERAPEUTICS AG (CH) 2025-11-04 — — US disclosed
US-20250243180-A1 TARGETED PROTEIN DEGRADATION MONTE ROSA THERAPEUTICS AG (CH) 2025-07-31 — — US disclosed
WO-2025024521-A1 SUBSTITUTED PIPERIDINEDIONES FOR TARGETED PROTEIN DEGRADATION MONTE ROSA THERAPEUTICS, INC. (US) 2025-01-30 — — WO 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-20250243180-A1 TARGETED PROTEIN DEGRADATION NEK7, NEK1, RIPK1 CACNA1H 4209/4885MPO 1433/4885CYP1A2 4493/4885
US-12459920-B2 Targeted protein degradation NEK7, NEK1, RIPK1 CACNA1H 4215/4885MPO 1434/4885CYP1A2 4503/4885
US-20250340528-A1 TARGETED PROTEIN DEGRADATION NEK7, NEK1, RIPK1 CACNA1H 4209/4885MPO 1433/4885CYP1A2 4493/4885

“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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