SCHEMBL1610285

SCHEMBL1610285

CCCCC/C=[C]\c1ccccc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
FAAH O00519 2/20 0.33
P2RX7 Q99572 1/20 0.33
LMNA P02545 1/20 0.33
TLR8 Q9NR97 1/20 0.32
SOAT2 O75908 1/20 0.32
SOAT1 P35610 1/20 0.32
FFAR1 O14842 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
DNM1 Q05193 2/20 0.32
TP53 P04637 2/20 0.31
ALDH1A1 P00352 2/20 0.31
ACHE P22303 1/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 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
SCHEMBL1611147 0.98 TSHR (0.38) TSHRFAAHP2RX7SOAT2SOAT1
SCHEMBL1609667 0.95 TSHR (0.41) TSHRP2RX7LMNAACHECYP3A4
SCHEMBL1612130 0.87 TSHR (0.43) TSHRFFAR1ALDH1A1ACHE
SCHEMBL1610884 0.86 TSHR (0.35) TSHRFAAHTLR8FFAR1
SCHEMBL1609952 0.85 CNR1 (0.35) TSHRFAAHP2RX7TLR8FFAR1
SCHEMBL1612354 0.81 TSHR (0.36) TSHRTLR8FFAR1
SCHEMBL1610837 0.80 TLR8 (0.36) TSHRFAAHP2RX7LMNATLR8
SCHEMBL1610562 0.79 TLR8 (0.33) LMNATLR8TDP1TP53ALDH1A1
SCHEMBL1612160 0.79 CNR1 (0.33) LMNATLR8FFAR1TDP1ALDH1A1
SCHEMBL1611529 0.79 TSHR (0.46) TSHRFFAR1TDP1ALDH1A1ACHE

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 TSHR 2994/4885FAAH 4640/4885P2RX7 2843/4885

“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.