SCHEMBL3774124

SCHEMBL3774124

CN(C)CCCn1nc(C2=C(c3cn(-c4ccc5ccccc5c4)c4ccccc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 16/20 1.00
PRKCB P05771 15/20 1.00
GSK3B P49841 14/20 1.00
PRKCG P05129 13/20 1.00
PRKCD Q05655 9/20 1.00
KCNH2 Q12809 8/20 1.00
PRKCZ Q05513 4/20 1.00
KISS1R Q969F8 1/20 0.53
PRKCH P24723 3/20 0.52
PRKCQ Q04759 3/20 0.52
PRKACA P17612 3/20 0.50
PRKACG P22612 3/20 0.50
PRKACB P22694 3/20 0.50
PIM1 P11309 2/20 0.50
PRKCE Q02156 2/20 0.47
CAMK2D Q13557 1/20 0.47
MEN1 O00255 1/20 0.47
PRKD3 O94806 1/20 0.47
CCNB2 O95067 1/20 0.47
CCNE2 O96020 1/20 0.47

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
SCHEMBL5759641 0.97 PRKCA (0.95) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5758391 0.95 GSK3B (0.90) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5758194 0.94 GSK3B (0.88) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5790814 0.93 PRKCA (0.86) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5757630 0.91 GSK3B (0.84) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5803991 0.90 GSK3B (0.83) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL2985115 0.90 GSK3B (0.82) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5814373 0.89 PRKCA (1.00) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL3774788 0.89 GSK3B (0.80) PRKCAPRKCBGSK3BPRKCGPRKCD
SCHEMBL5757856 0.89 GSK3B (1.00) PRKCAPRKCBGSK3BPRKCGPRKCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7855203-B2 Indazolyl-substituted pyrroline compounds as kinase inhibitors ORTHO-MCNEIL-JANSSEN PHARMACEUTICALS, INC. (US) 2010-12-21 US disclosed
US-20080096949-A1 Indazolyl-substituted pyrroline compounds as kinase inhibitors ORTHO-MCNEIL-JANSSEN PHARMACEUTICALS, INC. 2008-04-24 US disclosed
US-7329657-B2 Indazolyl-substituted pyrroline compounds as kinase inhibitors ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2008-02-12 US disclosed
US-7304060-B2 Indazolyl-substituted pyrroline compounds as kinase inhibitors ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2007-12-04 US disclosed
EP-1362047-B1 INDAZOLYL-SUBSTITUTED PYRROLINE COMPOUNDS AS KINASE INHIBITORS ORTHO MCNEIL PHARM INC (US) 2006-05-17 EP disclosed
US-6849643-B2 Indazolyl-substituted pyrroline compounds as kinase inhibitors ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2005-02-01 US disclosed
US-20050004202-A1 Indazolyl-substituted pyrroline compounds as kinase inhibitors ZHANG HAN-CHENG (US) 2005-01-06 US disclosed
US-20040259928-A1 Indazolyl-substituted pyrroline compounds as kinase inhibitors ZHANG HAN-CHENG (US) 2004-12-23 US disclosed
US-20030055097-A1 Indazolyl-substituted pyrroline compounds as kinase inhibitors ORTHO-MCNEIL PHARMACEUTICAL, INC. 2003-03-20 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 (4 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-20080096949-A1 Indazolyl-substituted pyrroline compounds as kinase inhibitors MAP2K2, MAP3K20, MAP2K3 PRKCA 43/4885PRKCB 40/4885GSK3B 601/4885
US-20040259928-A1 Indazolyl-substituted pyrroline compounds as kinase inhibitors MAP2K2, MAP3K20, MAP3K1 PRKCA 53/4885PRKCB 51/4885GSK3B 587/4885
US-20030055097-A1 Indazolyl-substituted pyrroline compounds as kinase inhibitors MAP2K2, MAP3K20, MAP3K1 PRKCA 53/4885PRKCB 51/4885GSK3B 587/4885
US-20050004202-A1 Indazolyl-substituted pyrroline compounds as kinase inhibitors MAP2K2, MAP3K20, MAP2K3 PRKCA 43/4885PRKCB 40/4885GSK3B 601/4885

“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.