SCHEMBL900658

SCHEMBL900658

[CH2]Cc1cc(Cl)c(Cl)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.38
AHR P35869 2/20 0.38
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP3A4 P08684 2/20 0.33
IDO1 P14902 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
FLT1 P17948 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL147692 0.79 GPR84 (0.37) CYP3A4CYP1A2CYP2C9CYP2C19TDP1
SCHEMBL7953262 0.75 AHR (0.42) MAPK1AHRHPGDTSHRHSD17B10
SCHEMBL1004617 0.74 MAPK1 (0.32) MAPK1AHR
SCHEMBL11779597 0.73 AHR (0.40) MAPK1AHRHPGDTSHRHSD17B10
SCHEMBL11219358 0.71 GRIN2D (0.52) MAPK1AHRHPGDTSHRHSD17B10
SCHEMBL9396186 0.71 MAPK1 (0.38) MAPK1AHRHPGDTSHRHSD17B10
SCHEMBL9567411 0.71 HSD17B10 (0.41) MAPK1AHRHPGDTSHRHSD17B10
SCHEMBL11314527 0.71 IDO1 (0.54) MAPK1AHRHPGDTSHRHSD17B10
SCHEMBL9567410 0.71 MAPK1 (0.38) MAPK1AHRHPGDTSHRHSD17B10
SCHEMBL130659 0.70 IDO1 (0.60) MAPK1CYP3A4IDO1CYP1A2CYP2C9

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 EP disclosed
EP-2621922-A1 A PROCESS FOR THE SYNTHESIS OF THIO-TRIAZOLO-GROUP CONTAINING COMPOUNDS BASF SE (DE) 2013-08-07 EP disclosed
WO-2012041858-A1 A PROCESS FOR THE SYNTHESIS OF THIO-TRIAZOLO-GROUP CONTAINING COMPOUNDS BASF SE (DE) 2012-04-05 WO disclosed
US-7514519-B2 Polymer obtained by using silsesquioxane derivative CHISSO CORPORATION (JP) 2009-04-07 US disclosed
US-7423107-B2 Polymer obtained with silsesquioxane derivative CHISSO PETROCHEMICAL CORPORATION (JP) 2008-09-09 US disclosed
EP-1686133-B1 Organosilicon compound CHISSO CORP (JP) 2008-08-20 EP disclosed
US-7375170-B2 Organosilicon compound CHISSO CORPORATION (JP) 2008-05-20 US disclosed
EP-1849788-A1 Organosilicon compound Chisso Corporation (JP) 2007-10-31 EP disclosed
EP-1849787-A1 Organosilicon compound Chisso Corporation (JP) 2007-10-31 EP disclosed
US-7235619-B2 Silsesquioxane derivative CHISSO CORPORATION (JP) 2007-06-26 US disclosed
US-20060116499-A1 Three-dimensional ladder polymer that has, as a main chain, a silsesquioxane skeleton having a structure of the cage structure of octasilsesquioxane with two broken corners reacted with unsaturated silanes, unsaturated disilanes, unsaturated polysiloxanes, or unsaturated hydrocarbons; solvent resistance JNC CORPORATION (JP) 2006-06-01 US disclosed
US-7053167-B2 Silsesquioxane derivative having functional group CHISSO CORPORATION (JP) 2006-05-30 US disclosed
US-20060100410-A1 Polymer obtained with silsesquioxane derivative JNC PETROCHEMICAL CORPORATION (JP) 2006-05-11 US disclosed
US-20060089504-A1 Silsesquioxane derivative having functional group ITO KENYA 2006-04-27 US disclosed
US-20050215807-A1 Silsesquioxane derivative JNC CORPORATION (JP) 2005-09-29 US disclosed
US-20040068074-A1 Production process for silsesquioxane derivative having functional group and silsesquioxane derivative JNC CORPORATION (JP) 2004-04-08 US disclosed
US-20040030084-A1 Production process for silsesquioxane derivative and silsesquioxane derivative JNC CORPORATION (JP) 2004-02-12 US disclosed
US-4849388-A DIORGANOTIN BIS/2-DIKETONATE/ RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1989-07-18 US disclosed
US-4749766-A Organotin curing catalyst for vulcanizable organopolysiloxanes RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1988-06-07 US disclosed
US-4567135-A DIFFUSION TRANSFER, COUPLERS OF DIFFERENT REACTION SPEEDS FUJI PHOTO FILM CO., LTD. (JP) 1986-01-28 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 (2 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-20050215807-A1 Silsesquioxane derivative STS, SFXN1, SULT1A1 MAPK1 1845/4885AHR 3069/4885HPGD 664/4885
US-20060089504-A1 Silsesquioxane derivative having functional group SFXN1, STS, SRM MAPK1 3522/4885AHR 1897/4885HPGD 2571/4885

“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.