SCHEMBL5906357

SCHEMBL5906357

COc1ccc2c(c1)c1c3c(c4c5ccccc5n(C)c4c1n2CCC#N)C(=O)NC3=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYLK Q15746 11/20 1.00
PRKACA P17612 4/20 0.60
CDK2 P24941 3/20 0.60
KDR P35968 2/20 0.60
PRKD3 O94806 2/20 0.60
PRKCG P05129 2/20 0.60
PRKCB P05771 2/20 0.60
PRKCA P17252 2/20 0.60
PRKCH P24723 2/20 0.60
PRKCI P41743 2/20 0.60
PRKCE Q02156 2/20 0.60
PRKCQ Q04759 2/20 0.60
PRKCZ Q05513 2/20 0.60
PRKCD Q05655 2/20 0.60
PRKD1 Q15139 2/20 0.60
PLK4 O00444 1/20 0.60
AURKA O14965 1/20 0.60
PDPK1 O15530 1/20 0.60
JAK2 O60674 1/20 0.60
ROCK2 O75116 1/20 0.60

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
SCHEMBL8112576 1.00 MYLK (1.00) MYLKPRKACACDK2KDRPRKD3
SCHEMBL8112540 0.95 MYLK (1.00) MYLKPRKACACDK2KDRPRKD3
SCHEMBL8127265 0.94 MYLK (1.00) MYLKPRKACACDK2KDRPRKD3
SCHEMBL8121222 0.94 MYLK (1.00) MYLKPRKACACDK2KDRPRKD3
SCHEMBL8123530 0.93 MYLK (0.88) MYLKPRKACACDK2KDRPRKD3
SCHEMBL8121530 0.91 MYLK (0.91) MYLKPRKACACDK2KDRPRKD3
SCHEMBL8126320 0.89 MYLK (0.91) MYLKPRKACACDK2KDRPRKD3
SCHEMBL8127306 0.89 MYLK (0.80) MYLKPRKACACDK2KDRPRKD3
SCHEMBL8115236 0.89 MYLK (1.00) MYLKPRKACACDK2KDRPRKD3
SCHEMBL8113275 0.89 MYLK (0.87) MYLKPRKACACDK2KDRPRKD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060009492-A1 Cancer treatment with compounds inhibiting PKC alpha LU ZHIMIN 2006-01-12 US claimed
EP-0642513-B1 INDOLOCARBAZOLE IMIDES AND THEIR USE KTB TUMORFORSCHUNGSGESELLSCHAF (DE) 2000-08-09 EP claimed
US-20080009511-A1 Cancer treatment with compounds inhibiting PKC alpha LU ZHIMIN 2008-01-10 US disclosed
US-20060009492-A1 Cancer treatment with compounds inhibiting PKC alpha LU ZHIMIN 2006-01-12 US disclosed
EP-0642513-B1 INDOLOCARBAZOLE IMIDES AND THEIR USE KTB TUMORFORSCHUNGSGESELLSCHAF (DE) 2000-08-09 EP disclosed
US-5945440-A Indolocarbazole imides and the use thereof GOEDECKE AKTIENGESELLSCHAFT (DE) 1999-08-31 US disclosed
US-5883114-A TREATING CANCEROUS TUMORS, INFLAMMATORY DISEASES, AND ALLERGIES GOEDECKE AKTIENGESELLSCHAFT (DE) 1999-03-16 US disclosed
EP-0642513-A1 INDOLOCARBAZOLE IMIDES AND THEIR USE GÖDECKE AKTIENGESELLSCHAFT (DE) 1995-03-15 EP disclosed
WO-1993024491-A1 INDOLOCARBAZOLE IMIDES AND THEIR USE Gödecke Aktiengesellschaft (DE) 1993-12-09 WO disclosed
WO-1993024490-A1 USE OF INDOLOCARBAZOLS IN AIDS TREATMENT Gödecke Aktiengesellschaft (DE) 1993-12-09 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 (2 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-20080009511-A1 Cancer treatment with compounds inhibiting PKC alpha PRKCE, ROCK1, PRKCA MYLK 1440/4885PRKACA 15/4885CDK2 716/4885
US-20060009492-A1 Cancer treatment with compounds inhibiting PKC alpha PRKCE, ROCK1, PRKCA MYLK 1440/4885PRKACA 15/4885CDK2 716/4885

“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.