SCHEMBL3662671

SCHEMBL3662671

Cc1cccc(-c2cc(-c3cncc(Br)c3)cc(NC3CC3)n2)n1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.37
BTK Q06187 3/20 0.37
CLK2 P49760 2/20 0.37
CLK3 P49761 2/20 0.37
DYRK1A Q13627 2/20 0.37
CYP2A6 P11509 1/20 0.36
IDH1 O75874 1/20 0.36
PIM2 Q9P1W9 3/20 0.36
PIM1 P11309 2/20 0.36
PIM3 Q86V86 1/20 0.36
CCR1 P32246 1/20 0.36
CCR8 P51685 1/20 0.36
CYP11B2 P19099 2/20 0.35
IRAK4 Q9NWZ3 1/20 0.34
CDC7 O00311 1/20 0.33
GPR39 O43194 1/20 0.33
CCNT1 O60563 1/20 0.33
OPRM1 P35372 1/20 0.32
CYP11B1 P15538 1/20 0.32

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
SCHEMBL3665002 0.83 GPR39 (0.47) EGFRBTKPIM2PIM1PIM3
SCHEMBL3664246 0.82 CLK2 (0.39) EGFRBTKCLK2CLK3DYRK1A
SCHEMBL3664857 0.82 CYP2A6 (0.38) CYP2A6CCR1CCR8CYP11B2CYP11B1
SCHEMBL3662940 0.81 EGFR (0.36) EGFRBTKCLK2CLK3DYRK1A
SCHEMBL4186447 0.80 DYRK1A (0.37) EGFRBTKCLK2CLK3DYRK1A
SCHEMBL3660634 0.79 DNMT1 (0.39) CLK2CLK3DYRK1APIM2PIM1
SCHEMBL3664859 0.79 GPR39 (0.51) PIM1CDC7GPR39
SCHEMBL3663909 0.79 GPR39 (0.54) CDC7GPR39
SCHEMBL3658012 0.78 CYP2A6 (0.43) CYP2A6CCR1CCR8CYP11B2CYP11B1
SCHEMBL3661584 0.78 GABRG2 (0.47) CDC7GPR39

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2242742-B1 PYRIDINE DERIVATIVES NOVARTIS AG (CH) 2015-12-02 EP disclosed
US-8343966-B2 Organic compounds NOVARTIS AG (CH) 2013-01-01 US disclosed
EP-2242742-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2010-10-27 EP disclosed
US-20090215776-A1 Organic compounds ADCOCK CLAIRE 2009-08-27 US disclosed
WO-2009087212-A2 PYRIDINE DERIVATIVES NOVARTIS AG (CH) 2009-07-16 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-20090215776-A1 Organic compounds REN, RXFP1, MYLK EGFR 3844/4885BTK 3224/4885CLK2 4562/4885

“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.