SCHEMBL21390942

SCHEMBL21390942

O=C(CCCc1nc2ccc(Cl)nc2n1C1CCC1)CC1CCOC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 4/20 0.32
CYP11B1 P15538 3/20 0.32
BRD4 O60885 1/20 0.32
CREBBP Q92793 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL21390934 0.92 CYP11B2 (0.32) CYP11B2CYP11B1BRD4CREBBP
SCHEMBL21390713 0.80 CYP11B2 (0.36) CYP11B2CYP11B1
SCHEMBL21390950 0.80 CYP11B2 (0.36) CYP11B2CYP11B1
SCHEMBL21390721 0.78 CYP11B2 (0.35) CYP11B2CYP11B1
SCHEMBL16084143 0.78 P2RX7 (0.41) CYP11B2CYP11B1CNR1CNR2
SCHEMBL21390976 0.77 CYP11B2 (0.37) CYP11B2CYP11B1
SCHEMBL21390982 0.76 TDP1 (0.35) CYP11B2CYP11B1
SCHEMBL21390858 0.76 CYP11B2 (0.33) CYP11B2CYP11B1
SCHEMBL24847872 0.75 PIK3CA (0.36) CYP11B2BRD4CREBBPCNR1
SCHEMBL16084287 0.75 GBA1 (0.37) CYP11B2CYP11B1BRD4CREBBP

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
WO-2019183148-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KNOPP BIOSCIENCES LLC (US) 2019-09-26 WO disclosed