SCHEMBL18287359

SCHEMBL18287359

CC(C)P(c1cc(-c2ccccc2)ccc1N(c1ccccc1)c1ccc(-c2ccccc2)cc1P(C(C)C)C(C)C)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.34
PTGS2 P35354 2/20 0.33
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
MEN1 O00255 1/20 0.31
APAF1 O14727 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
XBP1 P17861 1/20 0.31
PTBP1 P26599 1/20 0.31
HTT P42858 1/20 0.31
GALK1 P51570 1/20 0.31
BLM P54132 1/20 0.31
SMAD3 P84022 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL18287353 0.84 TAAR1 (0.34) SIGMAR1PTGS2NPC1RAB9AMEN1
SCHEMBL18287349 0.83 POLB (0.33) SIGMAR1
SCHEMBL18287352 0.81 CRHR1 (0.35) SIGMAR1MAPTL3MBTL1
SCHEMBL2851944 0.80 TSHR (0.37) SIGMAR1MAPTL3MBTL1
SCHEMBL18287357 0.79 CYP2D6 (0.38) NPC1RAB9AMEN1KMT2ANPSR1
SCHEMBL18287356 0.74 CYP2C19 (0.36) NPC1RAB9ATHRBHTT
SCHEMBL18287376 0.74 MAPT (0.36) PTGS2NPC1RAB9AMEN1APAF1
SCHEMBL18287341 0.73 ALOX5 (0.34) PTGS2NPC1RAB9AMEN1APAF1
SCHEMBL18287345 0.71 CYP3A4 (0.35) PTGS2NPC1RAB9AMEN1APAF1
SCHEMBL12533881 0.69 HSD17B1 (0.38) MEN1LMNAMAPTHTTKMT2A

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-20160359126-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-12-08 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-20160359126-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME OXA1L, MAL2, L1CAM SIGMAR1 2683/4885PTGS2 2468/4885NPC1 2946/4885

“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.