SCHEMBL6383971

SCHEMBL6383971

CCOc1ccc2c(N(C)c3ccccc3)c(C#N)cnc2c1OCC

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ STK4 Q13043 2/20 0.55
▸ LRRK2 Q5S007 1/20 0.45
▸ TSHR P16473 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.35
▸ PIP4K2A P48426 1/20 0.34
▸ EGFR P00533 2/20 0.33
▸ ERBB2 P04626 2/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ RORC P51449 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ SRC P12931 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PKM P14618 1/20 0.32

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
SCHEMBL6382054 0.80 STK4 (0.73) STK4LRRK2EGFRERBB2SRC
SCHEMBL6385221 0.76 STK4 (0.55) STK4EGFRERBB2SRC
SCHEMBL7002420 0.75 STK4 (0.34) STK4SLC6A3EGFRERBB2ALDH1A1
SCHEMBL22419654 0.71 STK4 (1.00) STK4LRRK2EGFRERBB2
SCHEMBL6383103 0.70 PRKCQ (0.39) STK4EGFRERBB2ALDH1A1SRC
SCHEMBL27460476 0.69 EGFR (0.61) STK4LRRK2EGFRERBB2SRC
SCHEMBL6384516 0.68 EGFR (0.54) STK4EGFRERBB2SRC
SCHEMBL6382237 0.68 EGFR (0.58) STK4EGFRERBB2SRC
SCHEMBL6383793 0.68 EGFR (0.58) STK4EGFRERBB2SRC
SCHEMBL27480999 0.67 STK4 (0.55) STK4EGFRERBB2SRC

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-1263503-B1 USE OF CYANOQUINOLINES FOR TREATING OR INHIBITING COLONIC POLYPS WYETH CORP (US) 2005-11-02 — — EP claimed
EP-0973746-B1 SUBSTITUTED 3-CYANO QUINOLINES WYETH CORP (US) 2003-09-24 — — EP claimed
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