SCHEMBL2659990

SCHEMBL2659990

CCON(CC)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
ALDH1A1 P00352 4/20 0.46
LMNA P02545 3/20 0.44
CNR2 P34972 1/20 0.44
AOC3 Q16853 1/20 0.43
MAPK1 P28482 2/20 0.43
G6PC1 P35575 1/20 0.43
MGLL Q99685 1/20 0.42
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
TP53 P04637 1/20 0.41
HSD17B10 Q99714 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALOX15 P16050 1/20 0.41
BCHE P06276 1/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL8423289 0.91 TSHR (0.50) TSHRALDH1A1LMNACNR2AOC3
Alcohol SCHEMBL7695411 0.86 G6PC1 (0.46) TSHRALDH1A1LMNAAOC3MAPK1
SCHEMBL10477327 0.86 TSHR (0.47) TSHRALDH1A1LMNACNR2AOC3
SCHEMBL27446334 0.84 ALDH1A1 (0.43) TSHRALDH1A1LMNACNR2AOC3
SCHEMBL23019706 0.81 ALDH1A1 (0.41) TSHRALDH1A1LMNACNR2AOC3
SCHEMBL17632159 0.81 TSHR (0.41) TSHRALDH1A1LMNACNR2AOC3
SCHEMBL12604504 0.81 TSHR (0.50) TSHRALDH1A1LMNACNR2AOC3
SCHEMBL9079988 0.80 LTA4H (0.52)
SCHEMBL23867189 0.80 SMN1; SMN2 (0.41) TSHRALDH1A1LMNAAOC3MAPK1
SCHEMBL9178257 0.78 TSHR (0.47) TSHRALDH1A1LMNACNR2AOC3

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
CN-106398581-A Antistatic agent for adhesive 第工业制药株式会社 2017-02-15 CN disclosed
US-20040097557-A1 Cyanothiophene derivatives, compositions containing such compounds and methods of use DUFFY JOSEPH L (US) 2004-05-20 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-20040097557-A1 Cyanothiophene derivatives, compositions containing such compounds and methods of use GLP1R, GPR119, GCGR TSHR 106/4885ALDH1A1 2652/4885LMNA 3295/4885

“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.