SCHEMBL21362369

SCHEMBL21362369

c1ccc(N(c2cccc(-n3ccnc3)c2)c2cc(Oc3ccccn3)cc3c2oc2ccccc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
NOS2 P35228 1/20 0.35
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
CYP3A4 P08684 3/20 0.33
PTGS2 P35354 1/20 0.33
CYP2D6 P10635 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP1A2 P05177 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
CYP19A1 P11511 3/20 0.32
IDO1 P14902 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
F2 P00734 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
SCHEMBL21362375 0.91 TSHR (0.40) TSHRKDM4EUSP2POLBHPGD
SCHEMBL21362293 0.83 NPC1 (0.45) USP2POLBHPGDNPC1MAPT
SCHEMBL21362324 0.82 NPC1 (0.40) USP2NOS2NPC1MAPTCYP3A4
SCHEMBL21362289 0.81 PTGS2 (0.34) USP2NPC1MAPTPTGS2
SCHEMBL21362326 0.81 NPC1 (0.40) POLBNOS2NPC1MAPTCYP3A4
SCHEMBL21362373 0.77 NPC1 (0.41) USP2POLBNOS2NPC1MAPT
SCHEMBL21362345 0.76 CYP3A4 (0.33) TSHRKDM4EUSP2POLBHPGD
SCHEMBL21362350 0.76 NOS2 (0.39) USP2NOS2NPC1MAPTCYP3A4
SCHEMBL21362325 0.72 CYP11B1 (0.40) POLBNOS2NPC1MAPTCYP3A4
SCHEMBL21362327 0.71 NPC1 (0.53) USP2POLBNOS2NPC1MAPT

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-20190288223-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-19 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-20190288223-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME TPO, RPLP0, RPS10 TSHR 92/4885KDM4E 3171/4885USP2 3433/4885

“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.