SCHEMBL2738453

SCHEMBL2738453

NC(=O)[C@H](CN1CCCOCC1)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 2/20 0.48
▸ ALDH1A1 P00352 4/20 0.48
▸ MAPT P10636 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ LMNA P02545 3/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ MITF O75030 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ HTR1A P08908 1/20 0.42
▸ MAOA P21397 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ CD274 Q9NZQ7 1/20 0.42
▸ HTT P42858 1/20 0.41
▸ P2RX7 Q99572 1/20 0.41

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
SCHEMBL2738454 1.00 NTSR1 (0.48) NTSR1ALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL8223736 0.95 ALDH1A1 (0.49) NTSR1ALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL17424834 0.95 ALDH1A1 (0.49) NTSR1ALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL8223281 0.88 NTSR1 (0.56) NTSR1ALDH1A1MITFSMN1; SMN2ATM
SCHEMBL2739137 0.88 NTSR1 (0.56) NTSR1ALDH1A1MITFSMN1; SMN2ATM
SCHEMBL2738589 0.88 NTSR1 (0.56) NTSR1ALDH1A1MITFSMN1; SMN2ATM
SCHEMBL2738767 0.88 NTSR1 (0.59) NTSR1ALDH1A1MITFSMN1; SMN2ATM
SCHEMBL12188383 0.87 PAX8 (0.52) NTSR1ALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL12188386 0.87 PAX8 (0.52) NTSR1ALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL680792 0.85 ALDH1A1 (0.49) NTSR1ALDH1A1MAPTKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2966065-A2 HYDROXYLATED AND METHOXYLATED CYCLOPENTA [D] PYRIMIDINES AS AKT PROTEIN KINASE INHIBITORS Array Biopharma, Inc. (US) 2016-01-13 — — EP disclosed
EP-2402325-B1 Hydroxylated cyclopenta[d]pyrimidines as AKT protein kinase inhibitors ARRAY BIOPHARMA INC (US) 2015-08-26 — — EP disclosed
EP-2402325-A2 Hydroxylated and methoxylated cyclopenta[d]pyrimidines as AKT protein kinase inhibitors Array Biopharma, Inc. (US) 2012-01-04 — — EP disclosed
EP-2399909-A1 Hydroxylated and methoxylated cyclopenta[d]pyrimidines as akt protein kinase inhibitors Array Biopharma, Inc. (US) 2011-12-28 — — EP disclosed
WO-2008006040-A1 HYDROXYLATED AND METHOXYLATED CYCLOPENTA [D] PYRIMIDINES AS AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2008-01-10 — — WO disclosed
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