SCHEMBL18871772

SCHEMBL18871772

CC(=O)N1CCCc2cc(-c3ccc(C(=O)O)cn3)ccc21

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 11/20 0.54
▸ CYP11B1 P15538 9/20 0.54
▸ NOTUM Q6P988 3/20 0.48
▸ P4HA1 P13674 2/20 0.47
▸ P4HTM Q9NXG6 1/20 0.47
▸ TP53 P04637 1/20 0.46
▸ LDHA P00338 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ LMNA P02545 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL18871773 0.85 CYP11B2 (0.54) CYP11B2CYP11B1ALDH1A1HPGD
SCHEMBL20429089 0.85 CYP11B2 (0.52) CYP11B2CYP11B1NOTUMTP53ALDH1A1
SCHEMBL18871768 0.84 CYP11B1 (0.58) CYP11B2CYP11B1NOTUMTP53ALDH1A1
SCHEMBL18871988 0.82 FYN (0.45) CYP11B2CYP11B1TP53ALDH1A1LMNA
SCHEMBL18871982 0.81 PDK1 (0.55) P4HA1P4HTM
SCHEMBL20894496 0.81 NOTUM (0.62) NOTUMTP53ALDH1A1KDM4EHPGD
SCHEMBL29631031 0.81 NOTUM (0.62) NOTUMTP53ALDH1A1KDM4EHPGD
SCHEMBL18871984 0.80 CYP11B2 (0.56) CYP11B2CYP11B1NOTUMTP53ALDH1A1
SCHEMBL20288815 0.79 CYP11B2 (0.50) CYP11B2CYP11B1NOTUMTP53ALDH1A1
SCHEMBL20288527 0.78 CYP11B2 (0.49) CYP11B2CYP11B1NOTUMTP53ALDH1A1

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
EP-3168213-A1 TETRAHYDROQUINOLINE DERIVATIVES USEFUL AS BROMODOMAIN INHIBITORS Glaxosmithkline LLC (US) 2017-05-17 — — EP disclosed
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