SCHEMBL20175204

SCHEMBL20175204

OC1(c2ccc(Cl)cc2-c2cc3ccccc3o2)c2ccccc2-c2c(Br)cccc21

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.50
MAOA P21397 4/20 0.50
PDK2 Q15119 3/20 0.39
PDE4D Q08499 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
BRD4 O60885 2/20 0.32
CREBBP Q92793 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
RAB9A P51151 1/20 0.32
PTPRC P08575 1/20 0.32
PTPN1 P18031 1/20 0.32
ALOX5 P09917 1/20 0.32

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
SCHEMBL20175210 0.93 MAOB (0.49) MAOBMAOAPDK2PDE4DLMNA
SCHEMBL20174689 0.90 MAOB (0.58) MAOBMAOAPDK2PDE4DBRD4
SCHEMBL20175209 0.78 MAOB (0.46) MAOBMAOAPDK2PDE4DLMNA
SCHEMBL20175207 0.74 MAOB (0.68) MAOBMAOAPDE4DLMNAMAPT
SCHEMBL20174687 0.72 MAOB (0.52) MAOBMAOAPDK2PDE4DMAPT
SCHEMBL20175208 0.71 MAOB (0.68) MAOBMAOAPDE4DLMNAMAPT
SCHEMBL20174691 0.69 MAOB (1.00) MAOBMAOAMAPTMEN1KMT2A
SCHEMBL19683792 0.69 PDK2 (0.51) PDK2MAPTMEN1KMT2A
SCHEMBL20175205 0.69 AHR (0.37) MAOAPDK2MAPT
SCHEMBL22522913 0.69 PDK2 (0.48) PDK2TSHRALOX5

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-20180145261-A1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 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 (1 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-20180145261-A1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME CRY1, NR2E3, ALDH1A2 MAOB 2695/4885MAOA 3157/4885PDK2 580/4885

“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.