SCHEMBL2738522

SCHEMBL2738522

NC(=O)[C@@H](Cc1ccc(Cl)cc1)NCC1CCOCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 3/20 0.41
PSEN2 P49810 3/20 0.41
APH1B Q8WW43 3/20 0.41
NCSTN Q92542 3/20 0.41
APH1A Q96BI3 3/20 0.41
PSENEN Q9NZ42 3/20 0.41
TACR2 P21452 1/20 0.40
CCR2 P41597 1/20 0.38
AVPR1A P37288 3/20 0.38
KCNH2 Q12809 1/20 0.38
NPY1R P25929 1/20 0.37
NPY5R Q15761 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CTSD P07339 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MC4R P32245 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL684454 0.90 ACACB (0.40) TACR2CCR2AVPR1AKCNH2NPY1R
SCHEMBL681505 0.85 CNR2 (0.40) TACR2CCR2AVPR1AKCNH2NPY1R
SCHEMBL2738925 0.82 LMNA (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL680259 0.81 SIGMAR1 (0.37) TACR2CCR2AVPR1ANPY1RNPY5R
SCHEMBL12188589 0.78 GPR142 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL10266645 0.76 ALDH1A1 (0.54) TACR2KCNH2NPC1RAB9ALMNA
SCHEMBL684223 0.74 CCR2 (0.41) CCR2AVPR1AKCNH2LMNAKMT2A
SCHEMBL681504 0.74 GPR142 (0.42) TACR2CCR2AVPR1AMC4RCYP2C9
SCHEMBL7971029 0.70 CYP2C19 (0.47) LMNAMEN1KMT2ACYP2C9CYP2C19
SCHEMBL2738906 0.70 CYP2C19 (0.47) LMNAMEN1KMT2ACYP2C9CYP2C19

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-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