SCHEMBL10137170

SCHEMBL10137170

CCCCOc1cc(I)c(-c2ccccc2)c2cc(SC)c(SC)cc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
LTA4H P09960 2/20 0.34
PTPN11 Q06124 2/20 0.34
THRA P10827 2/20 0.34
THRB P10828 2/20 0.34
PTPN1 P18031 1/20 0.33
TLR8 Q9NR97 1/20 0.33
CNR2 P34972 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
GAA P10253 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL15452271 0.94 THRA (0.35) BCHEACHECYP1A2CYP2C9CYP2C19
SCHEMBL15459695 0.89 THRA (0.33) BCHEACHECYP1A2CYP2C9CYP2C19
SCHEMBL4572111 0.86 CYP1A2 (0.47) BCHEACHECYP1A2CYP2C9CYP2C19
SCHEMBL4568722 0.84 MAPT (0.38) GAATDP1L3MBTL1
SCHEMBL15452336 0.82 CYP1A2 (0.43) BCHEACHECYP1A2CYP2C9CYP2C19
SCHEMBL10137154 0.82 PTPN11 (0.44) PTPN11THRATHRBPTPN1CNR2
SCHEMBL17733183 0.80 PTPN1 (0.42) BCHEACHECYP1A2CYP2C9CYP2C19
SCHEMBL15452270 0.78 PTPN11 (0.46) PTPN11THRATHRBPTPN1
SCHEMBL15449614 0.78 PIN1 (0.39) GAATDP1L3MBTL1
SCHEMBL13556892 0.78 BCHE (0.34) BCHEACHECYP1A2CYP2C9CYP2C19

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2463280-B1 CHROMENE COMPOUND TOKUYAMA CORP (JP) 2013-09-11 EP disclosed
US-8308996-B2 Chromene compound TOKUYAMA CORPORATION (JP) 2012-11-13 US disclosed
US-20120121934-A1 CHROMENE COMPOUND TOKUYAMA CORPORATION (JP) 2012-05-17 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-20120121934-A1 CHROMENE COMPOUND TST, CNOT1, CNOT9 BCHE 4131/4885ACHE 2105/4885CYP1A2 709/4885

“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.