SCHEMBL6603060

SCHEMBL6603060

CC(C)c1cc(N(C)C)c2cc(N)ccc2n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 3/20 0.38
EGFR P00533 1/20 0.38
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
ACHE P22303 1/20 0.35
NQO2 P16083 1/20 0.35
KDM4E B2RXH2 3/20 0.34
POLB P06746 2/20 0.34
LMNA P02545 1/20 0.34
CASP6 P55212 1/20 0.34
MAPT P10636 3/20 0.34
ALDH1A1 P00352 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HPGD P15428 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
SCHEMBL6616835 0.80 MCHR1 (0.44) NOS3NOS1NOS2ACHENQO2
SCHEMBL4073181 0.80 TERT (0.55) TERTEGFRNQO2KDM4EPOLB
SCHEMBL6605394 0.76 NUDT1 (0.44) TERTEGFRACHENQO2KDM4E
SCHEMBL6599742 0.76 ALDH1A1 (0.46) ACHEMAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL4824439 0.74 ADORA2A (0.54) EGFRACHEKDM4ELMNAMAPT
SCHEMBL6600141 0.70 EGFR (0.44) EGFRKDM4EPOLBLMNACASP6
SCHEMBL27314053 0.69 KDM4E (0.58) EGFRNOS3NOS1NOS2ACHE
SCHEMBL6606041 0.69 NQO2 (0.50) TERTACHENQO2KDM4EPOLB
SCHEMBL4820817 0.69 ACP1 (0.43) EGFRACHEKDM4EPOLBLMNA
SCHEMBL4823424 0.68 MAP4K4 (0.43) ACHEKDM4ELMNAMAPTALDH1A1

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-1373252-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT Aventis Pharma S.A. (FR) 2004-01-02 EP disclosed
WO-2002076975-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT AVENTIS PHARMA S.A. (FR) 2002-10-03 WO disclosed