SCHEMBL5848901

SCHEMBL5848901

CC(C)(C)OC(=O)N1CC[C@H]2[C@@H](C1)c1cc(-c3ccccc3Cl)cc3c1N2CCC3

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.40
HTR2C P28335 3/20 0.40
HTR2B P41595 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
USP30 Q70CQ3 6/20 0.39
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
STS P08842 1/20 0.38
DGAT2 Q96PD7 2/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
DRD2 P14416 2/20 0.37
TP53 P04637 1/20 0.37
GPR119 Q8TDV5 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
SCHEMBL5847225 0.97 MEN1 (0.39) HTR2AHTR2CHTR2BMEN1KMT2A
SCHEMBL5846989 0.95 MEN1 (0.41) MEN1KMT2AUSP30MAPTLMNA
SCHEMBL5846999 0.93 HTR2A (0.39) HTR2AHTR2CHTR2BMEN1KMT2A
SCHEMBL5847469 0.91 STS (0.39) HTR2AHTR2CHTR2BMEN1KMT2A
SCHEMBL5848567 0.91 HTR2C (0.41) HTR2AHTR2CHTR2BMEN1KMT2A
SCHEMBL5846950 0.91 HTR2A (0.40) HTR2AHTR2CHTR2BMEN1KMT2A
SCHEMBL5848904 0.90 STS (0.41) HTR2AHTR2CHTR2BMEN1KMT2A
SCHEMBL5847635 0.89 HTR2A (0.40) HTR2AHTR2CHTR2BNPC1RAB9A
SCHEMBL5847769 0.88 HTR2A (0.50) HTR2AHTR2CHTR2BNPC1RAB9A
SCHEMBL5847375 0.88 CNR1 (0.40) HTR2AHTR2CHTR2BMEN1KMT2A

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-7081455-B2 Substituted heterocycle fused gamma-carbolines BRISTOL-MYERS SQUIBB COMPANY (US) 2006-07-25 US disclosed