SCHEMBL13337102

SCHEMBL13337102

C[C@H](N)CNc1nc(-c2ccncc2)cc2cnccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKCD Q05655 12/20 1.00
PRKCH P24723 12/20 1.00
PRKCE Q02156 11/20 1.00
PRKCQ Q04759 9/20 1.00
PRKCA P17252 8/20 1.00
PRKCB P05771 4/20 1.00
CYP1A2 P05177 1/20 1.00
ROCK2 O75116 2/20 0.67
ROCK1 Q13464 2/20 0.67
PKN1 Q16512 2/20 0.67
PKN2 Q16513 2/20 0.67
PRKD1 Q15139 2/20 0.67
PRKCI P41743 3/20 0.51
LATS1 O95835 3/20 0.50
LATS2 Q9NRM7 2/20 0.50

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
SCHEMBL18391620 1.00 PRKCD (1.00) PRKCDPRKCHPRKCEPRKCQPRKCA
SCHEMBL13337146 0.85 PRKCD (0.74) PRKCDPRKCHPRKCEPRKCQPRKCA
SCHEMBL3326372 0.81 PRKCH (0.75) PRKCDPRKCHPRKCEPRKCQPRKCA
SCHEMBL13336981 0.80 PRKCH (1.00) PRKCDPRKCHPRKCEPRKCQPRKCA
SCHEMBL13337105 0.80 PRKCH (0.66) PRKCDPRKCHPRKCEPRKCQPRKCA
SCHEMBL3327285 0.79 PRKCH (1.00) PRKCDPRKCHPRKCEPRKCQPRKCA
SCHEMBL20805637 0.78 PRKCH (0.78) PRKCDPRKCHPRKCEPRKCQPRKCA
SCHEMBL3327608 0.77 PRKCH (1.00) PRKCDPRKCHPRKCEPRKCQPRKCA
SCHEMBL15644776 0.77 LATS1 (0.83) PRKCDPRKCHPRKCEPRKCQPRKCA
SCHEMBL19932555 0.77 LATS1 (0.83) PRKCDPRKCHPRKCEPRKCQPRKCA

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-20220001015-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS SEAPORT THERAPEUTICS, INC. 2022-01-06 US disclosed
US-20100130469-A1 2, 6-NAPHTHRIDINE DERIVATIVES VAN EIS MAURICE 2010-05-27 US disclosed
US-20100130469-A1 2, 6-NAPHTHRIDINE DERIVATIVES VAN EIS MAURICE 2010-05-27 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 (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-20220001015-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS LIPA, MALT1, SGMS1 PRKCD 3178/4885PRKCH 2425/4885PRKCE 3209/4885
US-20100130469-A1 2, 6-NAPHTHRIDINE DERIVATIVES PKN1, PKN2, CDK9 PRKCD 63/4885PRKCH 22/4885PRKCE 18/4885

“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.