SCHEMBL20203546

SCHEMBL20203546

CC(C)c1ccc2c(c1)Oc1cc(CC(C)c3ccc4c(c3)Sc3ccccc3N4c3ccccc3)ccc1N2c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.33
MIF P14174 1/20 0.32
HTR2C P28335 2/20 0.31
DRD3 P35462 2/20 0.31
HTR2B P41595 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
HTR1A P08908 1/20 0.31
ADRB3 P13945 1/20 0.31
HTR2A P28223 1/20 0.31
HTR6 P50406 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PTGS1 P23219 2/20 0.30
PTGS2 P35354 2/20 0.30
HDAC6 Q9UBN7 1/20 0.30
ADRA2A P08913 1/20 0.30

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
SCHEMBL20152507 0.81 BCHE (0.42) BCHEHTR2CDRD3HTR2BMEN1
SCHEMBL20152508 0.76 P2RX4 (0.39) MIFNPSR1
SCHEMBL26367338 0.75 PTGS1 (0.40) BCHEHTR2CDRD3HTR2BMEN1
SCHEMBL19849753 0.75 KMT2A (0.33) BCHEHTR2CDRD3HTR2BMEN1
SCHEMBL1102436 0.74 BCHE (0.42) BCHEHTR2CDRD3HTR2BMEN1
SCHEMBL15458030 0.72 MIF (0.36) MIFNPSR1PTGS1
SCHEMBL10331698 0.72 HDAC6 (0.40) BCHEHTR2CDRD3HTR2BMEN1
SCHEMBL24422035 0.71 CYP2D6 (0.43) BCHEHTR2CDRD3HTR2BKMT2A
SCHEMBL29617993 0.69 HDAC6 (0.50) BCHEHTR2CDRD3HTR2BMEN1
SCHEMBL12536831 0.69 HDAC6 (0.50) BCHEHTR2CDRD3HTR2BMEN1

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
US-11001752-B2 Double spiro organic compound and organic electronic element comprising same LG CHEM, LTD. (KR) 2021-05-11 US disclosed
US-20180148640-A1 DOUBLE SPIRO ORGANIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11001752-B2 Double spiro organic compound and organic electronic element comprising same DCX, TERT, TELO2 BCHE 3654/4885MIF 2682/4885HTR2C 3399/4885
US-20180148640-A1 DOUBLE SPIRO ORGANIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME DCX, TERT, TELO2 BCHE 3654/4885MIF 2682/4885HTR2C 3399/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.