SCHEMBL26413736

SCHEMBL26413736

CCOC(=O)c1ccn2ccc(F)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
KDM4E B2RXH2 7/20 0.45
ALDH1A1 P00352 4/20 0.45
HPGD P15428 3/20 0.45
GAA P10253 2/20 0.45
GLA P06280 1/20 0.45
POLB P06746 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
JMJD6 Q6NYC1 1/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL26132977 0.81 FNTA (0.49) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL26129570 0.81 KDM4E (0.50) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL9052803 0.78 TSHR (0.58) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL30935665 0.77 ALDH1A1 (0.47) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL26690191 0.77 TSHR (0.44) TSHRKDM4EALDH1A1HPGDGAA
Oxalic Acid SCHEMBL27545073 0.75 ALDH1A1 (0.54) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL4628672 0.74 TSHR (0.60) TSHRKDM4EALDH1A1HPGDPOLB
SCHEMBL10562029 0.72 TSHR (0.57) TSHRKDM4EALDH1A1HPGDPOLB
SCHEMBL367075 0.72 TSHR (0.57) TSHRALDH1A1HPGDGAAPOLB
SCHEMBL30755337 0.72 TSHR (0.57) TSHRKDM4EALDH1A1HPGDPOLB

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-2023183613-A2 INDOLIZINE COMPOUNDS FOR THE TREATMENT OF MENTAL DISORDERS OR INFLAMMATION TACTOGEN INC (US) 2023-09-28 WO disclosed