SCHEMBL13994041

SCHEMBL13994041

Cc1cc2[nH]ncc2cc1NC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ MAPT P10636 5/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ CHEK1 O14757 1/20 0.43
▸ TRPA1 O75762 3/20 0.42
▸ TRPM8 Q7Z2W7 1/20 0.42
▸ TRPV1 Q8NER1 1/20 0.42
▸ FGFR1 P11362 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ LATS1 O95835 1/20 0.39
▸ LATS2 Q9NRM7 1/20 0.39
▸ AXL P30530 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.39
▸ P2RX7 Q99572 2/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ METAP2 P50579 2/20 0.38
▸ PLK1 P53350 1/20 0.37
▸ PKM P14618 1/20 0.37

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
SCHEMBL13996670 0.84 L3MBTL1 (0.51) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL25683002 0.80 L3MBTL1 (0.61) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL29769140 0.75 CHEK1 (0.58) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL8404434 0.75 CHEK1 (0.58) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL18167974 0.75 L3MBTL1 (0.68) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL16845708 0.73 L3MBTL1 (0.57) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL13950560 0.72 ALDH1A1 (0.57) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL12233426 0.72 ROCK2 (0.58) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL13219425 0.72 L3MBTL1 (1.00) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL21024680 0.69 TRPA1 (0.46) L3MBTL1MAPTALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465726-B2 Substituted pyrrolo[2.3-B]pyridines OSI PHARMACEUTICALS, INC. (US) 2008-12-16 — — US disclosed
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