SCHEMBL1611237

SCHEMBL1611237

CCCCCC/C=[C]\c1cccc2cc3ccccc3cc12

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
PPARA Q07869 3/20 0.34
CYP2D6 P10635 1/20 0.34
OXER1 Q8TDS5 1/20 0.33
KCNH2 Q12809 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
SOAT2 O75908 1/20 0.33
SOAT1 P35610 1/20 0.33
CHAT P28329 1/20 0.33
PLA2G10 O15496 1/20 0.33
PPARG P37231 1/20 0.33
CNR1 P21554 1/20 0.33
CETP P11597 1/20 0.33
FAAH O00519 2/20 0.32
EPHX2 P34913 2/20 0.32
EPHX1 P07099 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
SCHEMBL1610267 0.98 MAPT (0.35) MAPTPPARACYP2D6OXER1MEN1
SCHEMBL1611797 0.94 MEN1 (0.35) MAPTCYP2D6OXER1MEN1NPC1
SCHEMBL1612559 0.88 CHAT (0.40) MAPTCYP2D6MEN1NPC1KMT2A
SCHEMBL1609453 0.88 ALDH1A1 (0.34) MAPTMEN1NPC1KMT2AATM
SCHEMBL1610676 0.86 CNR1 (0.38) MAPTCYP2D6MEN1NPC1KMT2A
SCHEMBL1609445 0.81 HTR1B (0.37) MAPTMEN1NPC1KMT2ACHAT
SCHEMBL27293170 0.81 HTR1B (0.37) MAPTMEN1NPC1KMT2ACHAT
SCHEMBL1611119 0.81 ALDH1A1 (0.36) MAPTMEN1KMT2AATM
SCHEMBL1611102 0.80 MAPT (0.42) MAPTCYP2D6MEN1NPC1KMT2A
SCHEMBL1612352 0.78 MAPT (0.40) MAPTCYP2D6MEN1NPC1KMT2A

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-20110087034-A1 Organic Semiconductor Material SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-04-14 US disclosed
EP-2248818-A1 ORGANIC SEMICONDUCTOR MATERIAL Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP 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-20110087034-A1 Organic Semiconductor Material OR10J3, TST, OR51E2 MAPT 3838/4885PPARA 3635/4885CYP2D6 533/4885

“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.