SCHEMBL3663705

SCHEMBL3663705

O=Cc1ccc(-c2cncc(-c3cc(NC4CC4)nc(-c4ccccn4)c3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR39 O43194 3/20 0.43
METAP1 P53582 1/20 0.40
CCR6 P51684 1/20 0.38
EGFR P00533 1/20 0.37
BTK Q06187 1/20 0.37
PIM2 Q9P1W9 2/20 0.37
SYK P43405 1/20 0.36
GSK3B P49841 2/20 0.36
DYRK1A Q13627 2/20 0.36
ABL1 P00519 1/20 0.36
PIM1 P11309 2/20 0.36
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35
ADORA1 P30542 1/20 0.35
FLT3 P36888 3/20 0.35
TYRO3 Q06418 3/20 0.35
MERTK Q12866 3/20 0.35
GAS6 Q14393 3/20 0.35
AXL P30530 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.34

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
SCHEMBL4192009 0.84 GPR39 (0.43) GPR39CCR6PIM2SYKDYRK1A
SCHEMBL3665002 0.82 GPR39 (0.47) GPR39CCR6EGFRBTKPIM2
SCHEMBL3714748 0.81 TGFBR1 (0.46) GPR39GSK3BDYRK1A
SCHEMBL3664859 0.80 GPR39 (0.51) GPR39GSK3BPIM1FLT3TYRO3
SCHEMBL3661666 0.79 GPR39 (0.45) GPR39CCR6PIM2ABL1PIM1
SCHEMBL3722403 0.79 CCNC (0.51)
SCHEMBL3721814 0.79 ACACB (0.46) SYKABL1
SCHEMBL3808218 0.78 ABL1 (0.44) GPR39ABL1CCNT1
SCHEMBL4175691 0.78 CYP1A2 (0.46) GPR39ABL1PIM1ADORA2BADORA1
SCHEMBL3663909 0.78 GPR39 (0.54) GPR39GSK3BFLT3TYRO3MERTK

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 GPR39 222/4885METAP1 3533/4885CCR6 795/4885

“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.