SCHEMBL3607198

SCHEMBL3607198

COc1ncccc1-c1ccnc(Nc2cccnc2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 7/20 0.51
PRKCA P17252 4/20 0.51
PRKCD Q05655 3/20 0.51
EGFR P00533 3/20 0.51
LCK P06239 2/20 0.51
PRKD3 O94806 1/20 0.51
PRKCG P05129 1/20 0.51
PRKCB P05771 1/20 0.51
PRKCH P24723 1/20 0.51
PRKCI P41743 1/20 0.51
ZAP70 P43403 1/20 0.51
PRKCE Q02156 1/20 0.51
PRKCQ Q04759 1/20 0.51
PRKCZ Q05513 1/20 0.51
PRKD1 Q15139 1/20 0.51
ACVR1 Q04771 2/20 0.50
EIF2AK2 P19525 1/20 0.49
BCR P11274 5/20 0.48
SRC P12931 2/20 0.48
GSK3B P49841 5/20 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
SCHEMBL13503014 0.90 PIK3C3 (0.53) ABL1PRKCAPRKCDEGFRLCK
SCHEMBL3609139 0.82 PIK3CG (0.55) ABL1PRKCAPRKCDEGFRLCK
SCHEMBL3613255 0.81 TEK (0.51) LCKDYRK1AAURKAKDRAURKB
SCHEMBL3607411 0.80 GSK3B (0.59) ABL1LCKACVR1GSK3BCDK4
SCHEMBL3603447 0.80 ABL1 (0.48) ABL1PRKCAPRKCDEGFRLCK
SCHEMBL3596098 0.79 CDK9 (0.76) ABL1LCKACVR1GSK3BCDK4
SCHEMBL3614099 0.79 ABL1 (0.63) ABL1PRKCAPRKCDLCKPRKD3
SCHEMBL3598695 0.79 JAK2 (0.56) ABL1PRKCAPRKCDEGFRLCK
SCHEMBL3617309 0.79 PIK3CA (0.64) ABL1PRKCAEGFRPRKD3ACVR1
SCHEMBL3616129 0.79 ABL1 (0.56) ABL1PRKCALCKBCRSRC

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-20100048597-A1 Organic Compounds and Their Uses NOVARTIS AG 2010-02-25 US disclosed
US-20100048597-A1 Organic Compounds and Their Uses NOVARTIS AG 2010-02-25 US disclosed
US-20100048597-A1 Organic Compounds and Their Uses NOVARTIS AG 2010-02-25 US disclosed
WO-2008079933-A2 HETEROARYL-HETEROARYL COMPOUNDS AS CDK INHIBITORS FOR THE TREATMENT OF CANCER, INFLAMMATION AND VIRAL INFECTIONS NOVARTIS AG (CH) 2008-07-03 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 (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-20100048597-A1 Organic Compounds and Their Uses OAT, OTC, AOX1 ABL1 3215/4885PRKCA 4612/4885PRKCD 4777/4885

“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.