SCHEMBL5953873

SCHEMBL5953873

CCCC1=Cc2ccc(Cl)cc2C1

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 5/20 0.32
AHR P35869 1/20 0.32
HTR6 P50406 1/20 0.32
GAA P10253 2/20 0.31
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
HTR2A P28223 2/20 0.31
HTR2B P41595 2/20 0.31
HTR1A P08908 1/20 0.31
HTR7 P34969 1/20 0.31
DRD3 P35462 1/20 0.31
METAP1 P53582 1/20 0.31
HTR2C P28335 1/20 0.31
POLB P06746 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
SCHEMBL5954140 0.90 MEN1 (0.37) MCHR1AHRDRD2DRD4HTR2A
SCHEMBL5953999 0.86 DRD2 (0.40) AHRHTR6GAADRD2DRD4
SCHEMBL5953678 0.86 MCHR1 (0.33) MCHR1AHRDRD2DRD4HTR2A
SCHEMBL2964955 0.79 ADRA2A (0.35) HTR2AHTR2BHTR1AHTR7DRD3
SCHEMBL5954085 0.77 DRD2 (0.38) DRD2DRD4HTR2AHTR2BDRD3
SCHEMBL1539753 0.74 HTR1A (0.51) DRD2DRD4HTR2AHTR2BHTR1A
SCHEMBL5953558 0.72 DRD2 (0.38) AHRDRD2DRD4HTR2AHTR2B
SCHEMBL5953680 0.71 DRD2 (0.41) AHRDRD2DRD4HTR2AHTR2B
Hydrochloric Acid SCHEMBL28666905 0.71 AHR (0.38) AHRDRD2DRD4HTR2AHTR2B
SCHEMBL2971828 0.70 NPC1 (0.34) GAAHTR2AHTR2BHTR1AHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060052620-A1 Preparation of substituted indenes BASELL POLYOLEFINE GMBH (DE) 2006-03-09 US claimed
EP-1492749-A1 PREPARATION OF SUBSTITUTED INDENES Basell Polyolefine GmbH (DE) 2005-01-05 EP claimed
WO-2003084904-A1 PREPARATION OF SUBSTITUTED INDENES BASELL POLYOLEFINE GMBH (DE) 2003-10-16 WO claimed
US-20060052620-A1 Preparation of substituted indenes BASELL POLYOLEFINE GMBH (DE) 2006-03-09 US disclosed
EP-1492749-A1 PREPARATION OF SUBSTITUTED INDENES Basell Polyolefine GmbH (DE) 2005-01-05 EP disclosed
WO-2003084904-A1 PREPARATION OF SUBSTITUTED INDENES BASELL POLYOLEFINE GMBH (DE) 2003-10-16 WO 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-20060052620-A1 Preparation of substituted indenes INTS9, CYP1A2, INF2 MCHR1 3787/4885AHR 140/4885HTR6 3765/4885

“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.