SCHEMBL3279741

SCHEMBL3279741

CCCCNc1cc(-c2ccccn2)nc(Cl)c1-c1c(F)cccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.42
CCR1 P32246 1/20 0.39
CCR5 P51681 1/20 0.39
CCR8 P51685 1/20 0.39
GPR39 O43194 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
PPP1CA P62136 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TYRO3 Q06418 10/20 0.37
MERTK Q12866 10/20 0.37
FLT3 P36888 7/20 0.37
GAS6 Q14393 7/20 0.37
AXL P30530 7/20 0.37
CCNT1 O60563 1/20 0.37
EGFR P00533 1/20 0.37
FGFR1 P11362 1/20 0.37
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL3277910 0.84 TYRO3 (0.42) NR4A2CCR1CCR5CCR8GPR39
SCHEMBL3279738 0.82 MAPK14 (0.43) CCR1CCR5CCR8GPR39L3MBTL1
SCHEMBL13385463 0.81 CCR1 (0.42) NR4A2CCR1CCR5CCR8GPR39
SCHEMBL13385480 0.79 CCR1 (0.38) CCR1CCR5CCR8GPR39L3MBTL1
SCHEMBL3280715 0.79 CCR1 (0.51) CCR1CCR5CCR8GPR39L3MBTL1
SCHEMBL13385471 0.76 IDH1 (0.39) CCR1CCR5CCR8GPR39L3MBTL1
SCHEMBL13385478 0.76 GPR39 (0.46) CCR1CCR5CCR8GPR39L3MBTL1
SCHEMBL13385459 0.74 GPR39 (0.36) CCR1CCR5CCR8GPR39L3MBTL1
SCHEMBL13385457 0.73 CCNT1 (0.37) CCR1CCR5CCR8GPR39L3MBTL1
SCHEMBL14086440 0.72 NR4A2 (0.39) NR4A2L3MBTL1HTTSMN1; SMN2CCNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7695728-B2 2-substituted pyridines, processes for their preparation and their use for controlling harmful fungi BASF AKTIENGESELLSCHAFT (DE) 2010-04-13 US disclosed
US-20070259919-A1 2-Substituted Pyridines, Processes for their Preparation and Their Use for Controlling Harmful Fungi BASF AKIENGESELLSCHAFT (DE) 2007-11-08 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 (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-20070259919-A1 2-Substituted Pyridines, Processes for their Preparation and Their Use for Controlling Harmful Fungi CYP4X1, CYCS, CYP2S1 NR4A2 779/4885CCR1 417/4885CCR5 816/4885

“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.