SCHEMBL4187055

SCHEMBL4187055

CCCCCn1ccc2cnc(Cl)nc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 2/20 0.41
TLR8 Q9NR97 11/20 0.41
LNPEP Q9UIQ6 1/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPC1 O15118 1/20 0.34
TSHR P16473 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
CDK4 P11802 1/20 0.34
CCND1 P24385 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
SCHEMBL3712175 0.83 PAK1 (0.35) KMT2ACDK4CCND1
SCHEMBL17066933 0.82 JAK2 (0.33) KMT2AALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL30881456 0.82 JAK2 (0.33) KMT2AALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL28793690 0.80 RPS6KA3 (0.33) KMT2A
SCHEMBL27845067 0.80 RPS6KA3 (0.36) KMT2ASMN1; SMN2
SCHEMBL4194087 0.76 LMNA (0.41) TLR8KMT2AALDH1A1KDM4ELMNA
SCHEMBL22638029 0.76 JAK2 (0.48)
SCHEMBL7504710 0.75 CDK4 (0.56) CDK4CCND1
SCHEMBL24150591 0.75 KMO (0.50) POLBMAPTSMN1; SMN2
SCHEMBL20576350 0.75 HRH4 (0.41) TLR8POLBKDM4ELMNAMAPT

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
EP-2029145-A2 PYRROLOPYRIMIDINE COMPOUNDS AND THEIR USES Novartis Ag (CH) 2009-03-04 EP disclosed
WO-2007140222-A2 PYRROLOPYRIMIDINE COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2007-12-06 WO disclosed