SCHEMBL5228613

SCHEMBL5228613

CC1CCN(c2c(-c3ccccc3)c(Cl)nc3ncnn23)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.48
ALDH1A1 P00352 6/20 0.48
MAPT P10636 6/20 0.48
TSHR P16473 4/20 0.48
NPSR1 Q6W5P4 3/20 0.43
GLA P06280 1/20 0.43
HPGD P15428 3/20 0.42
MAPK1 P28482 3/20 0.41
TP53 P04637 2/20 0.41
HSD17B10 Q99714 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
ALOX15 P16050 1/20 0.41
KMT2A Q03164 1/20 0.41
EGLN2 Q96KS0 1/20 0.41
KDM4E B2RXH2 4/20 0.40
SMN1; SMN2 Q16637 5/20 0.40
NPC1 O15118 1/20 0.40
CASP1 P29466 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL4813045 0.90 ALDH1A1 (0.45) LMNAALDH1A1MAPTTSHRNPSR1
SCHEMBL4810454 0.88 EGLN2 (0.41) LMNAALDH1A1MAPTTSHRNPSR1
SCHEMBL4819308 0.86 TP53 (0.42) LMNAALDH1A1MAPTTSHRNPSR1
SCHEMBL4819279 0.86 EGLN2 (0.40) LMNAALDH1A1MAPTTSHRNPSR1
SCHEMBL4821684 0.86 ALDH1A1 (0.47) LMNAALDH1A1MAPTTSHRNPSR1
SCHEMBL8917364 0.86 LMNA (0.44) LMNAALDH1A1MAPTTSHRNPSR1
SCHEMBL15341363 0.86 LMNA (0.43) LMNAALDH1A1MAPTTSHRNPSR1
SCHEMBL4821793 0.85 TSHR (0.45) LMNAALDH1A1MAPTTSHRNPSR1
SCHEMBL4929317 0.84 LMNA (0.44) LMNAALDH1A1MAPTTSHRNPSR1
SCHEMBL4820371 0.84 TSHR (0.48) LMNAALDH1A1MAPTTSHRNPSR1

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-7307172-B2 7-amino triazolopyrimidines for controlling harmful fungi BASF AKTIENGESELLSCHAFT (DE) 2007-12-11 US claimed
EP-1414302-B1 7-AMINO TRIAZOLOPYRIMIDINES FOR CONTROLLING HARMFUL FUNGI BASF AG (DE) 2007-03-21 EP claimed